SCHEMBL6717372

SCHEMBL6717372

CCc1nc2cc(C(F)(F)F)c(Cl)cc2n1-c1ccc(CCN(C(=O)O)S(=O)(=O)c2cccc3cnccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.38
P2RX7 Q99572 16/20 0.37
P2RX3 P56373 1/20 0.36
KCNH2 Q12809 1/20 0.36
FLT3 P36888 1/20 0.35
F2 P00734 1/20 0.35
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 1/20 0.34

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
SCHEMBL1624926 0.89 NR3C2 (0.36) P2RX7
SCHEMBL6714823 0.89 MEN1 (0.38) F2
SCHEMBL3949473 0.87 PTGER2 (0.37)
SCHEMBL3957947 0.83 NR1H2 (0.37) P2RX7
SCHEMBL1623250 0.83 PTGER4 (0.41)
SCHEMBL1624850 0.83 PTGER4 (0.35)
Hydrochloric Acid SCHEMBL6713111 0.82 PTGER4 (0.35)
Hydrochloric Acid SCHEMBL6718055 0.82 PTGER4 (0.35)
SCHEMBL6713167 0.81 PTGER4 (0.41)
SCHEMBL1625127 0.81 NR3C1 (0.34)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2004-09-16 US disclosed
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases SHIMOJO MASATO 2003-12-25 US disclosed
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PFIZER PHARMACEUTICALS INC. (JP) 2002-06-20 US 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 (3 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-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PTGER4, PTGER1, IL6 TRPV1 1401/4885P2RX7 442/4885P2RX3 493/4885
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 TRPV1 12/4885P2RX7 374/4885P2RX3 284/4885
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PTGER4, PTGER1, PTGER2 TRPV1 236/4885P2RX7 135/4885P2RX3 121/4885

“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.