SCHEMBL3947533

SCHEMBL3947533

[CH2]Cc1ccc(-n2c(CC)nc3cc(C(F)(F)F)c(Cl)cc32)cn1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
PDE10A Q9Y233 1/20 0.34
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
KCNH2 Q12809 1/20 0.32
NOTUM Q6P988 5/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
BMI1 P35226 2/20 0.32
FFAR4 Q5NUL3 1/20 0.32
RXRA P19793 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
OXTR P30559 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
MBOAT4 Q96T53 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1625742 0.88 CYP1A2 (0.33) CYP1A2PDE10ANR1H2NR1H3KCNH2
SCHEMBL1625697 0.88 NOTUM (0.41) CYP1A2PDE10ANR1H2NR1H3KCNH2
SCHEMBL1624729 0.87 PDPK1 (0.33) CYP1A2PDE10ANR1H2NR1H3KCNH2
SCHEMBL4045631 0.86 MEN1 (0.39) CYP1A2PDE10ANR1H2NR1H3NOTUM
SCHEMBL3949979 0.85 CNR2 (0.36) CYP1A2PDE10ANR1H2NR1H3NOTUM
SCHEMBL27582749 0.82 NOTUM (0.36) CYP1A2PDE10ANR1H2NR1H3KCNH2
SCHEMBL5799639 0.81 CNR2 (0.38) CYP1A2PDE10ANR1H2NR1H3NOTUM
SCHEMBL3949839 0.79 BMI1 (0.35) BMI1CNR1CNR2
SCHEMBL6455998 0.79 NR1H2 (0.33) CYP1A2PDE10ANR1H2NR1H3NOTUM
SCHEMBL3950715 0.78 CNR2 (0.38) CYP1A2PDE10ANR1H2NR1H3NOTUM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005102389-A9 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2009-04-30 WO claimed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US claimed
US-7479564-B2 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents RAQUALIA PHARMA INC. (JP) 2009-01-20 US claimed
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PFIZER INC. 2007-07-05 US claimed
EP-1740211-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-01-10 EP claimed
EP-1326864-B1 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMA (JP) 2006-03-15 EP claimed
WO-2005102389-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-03 WO claimed
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP claimed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO claimed
EP-2976105-B1 USE OF EP4 RECEPTOR ANTAGONISTS IN THE TREATMENT OF CARTILAGE DISEASE ASKAT INC (JP) 2023-01-04 EP disclosed
US-10786490-B2 Use of EP4 receptor antagonists in the treatment of cartilage disease ASKAT INC. (JP) 2020-09-29 US disclosed
US-10391086-B2 Use of EP4 receptor antagonists in the treatment of cartilage disease ASKAT INC. (JP) 2019-08-27 US disclosed
US-20180193324-A1 USE OF EP4 RECEPTOR ANTAGONISTS IN THE TREATMENT OF CARTILAGE DISEASE ASKAT INC. (JP) 2018-07-12 US disclosed
US-20170360764-A1 USE OF EP4 RECEPTOR ANTAGONISTS IN THE TREATMENT OF CARTILAGE DISEASE ASKAT INC. (JP) 2017-12-21 US disclosed
EP-1666480-A1 Aryl or Heteroaryl Fused Imidazole Compounds as intermediates for Anti-Inflammatory And Analgesic Agents. PFIZER PHARMACEUTICALS INC. (JP) 2006-06-07 EP disclosed
EP-1326864-B1 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMA (JP) 2006-03-15 EP disclosed
WO-2005102389-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-03 WO disclosed
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
US-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2002-08-08 US disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10391086-B2 Use of EP4 receptor antagonists in the treatment of cartilage disease PTGER4, PTGER1, EPB41 CYP1A2 3433/4885PDE10A 1022/4885NR1H2 686/4885
US-10786490-B2 Use of EP4 receptor antagonists in the treatment of cartilage disease PTGER4, PTGER1, PTGER3 CYP1A2 2974/4885PDE10A 1351/4885NR1H2 770/4885
US-20170360764-A1 USE OF EP4 RECEPTOR ANTAGONISTS IN THE TREATMENT OF CARTILAGE DISEASE PTGER4, PTGER1, PTGER3 CYP1A2 2974/4885PDE10A 1351/4885NR1H2 770/4885
US-20180193324-A1 USE OF EP4 RECEPTOR ANTAGONISTS IN THE TREATMENT OF CARTILAGE DISEASE PTGER4, PTGER1, EPB41 CYP1A2 3433/4885PDE10A 1022/4885NR1H2 686/4885
US-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 CYP1A2 139/4885PDE10A 3240/4885NR1H2 213/4885
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PTGS1, PTGS2, PTGES CYP1A2 65/4885PDE10A 1514/4885NR1H2 300/4885
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PTGER4, PTGER2, OPRL1 CYP1A2 1834/4885PDE10A 1889/4885NR1H2 422/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.