SCHEMBL3270105

SCHEMBL3270105

O=C(Cc1ccncc1)c1ccc(OCc2ccc3ccccc3n2)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.48
PDE10A Q9Y233 4/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GPBAR1 Q8TDU6 3/20 0.43
FFAR1 O14842 1/20 0.43
AKR1B1 P15121 1/20 0.43
CYSLTR1 Q9Y271 4/20 0.42
CYSLTR2 Q9NS75 2/20 0.41

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
SCHEMBL3275392 0.82 PDE10A (0.48) ALOX5PDE10AGPBAR1CYSLTR1
SCHEMBL3276740 0.82 ALOX5 (0.53) ALOX5PDE10AGPBAR1FFAR1AKR1B1
SCHEMBL3271777 0.82 GPBAR1 (0.56) ALOX5PDE10AMEN1NPC1MAPT
SCHEMBL3271540 0.80 GPBAR1 (0.48) ALOX5PDE10AMEN1NPC1MAPT
SCHEMBL3271791 0.78 PDE10A (0.48) ALOX5PDE10AGPBAR1CYSLTR1CYSLTR2
SCHEMBL3270051 0.77 GPBAR1 (0.66) ALOX5PDE10AGPBAR1FFAR1AKR1B1
SCHEMBL3272300 0.77 ALOX5 (0.50) ALOX5PDE10AGPBAR1CYSLTR1CYSLTR2
SCHEMBL3271686 0.75 PDE10A (0.65) ALOX5PDE10AGPBAR1FFAR1AKR1B1
SCHEMBL27696305 0.73 CYSLTR1 (0.46) ALOX5PDE10AGPBAR1FFAR1AKR1B1
SCHEMBL9031804 0.73 FFAR1 (0.55) ALOX5PDE10AGPBAR1FFAR1AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825254-B2 Heteroaromatic quinoline compounds PFIZER INC. (US) 2010-11-02 US disclosed
EP-1841757-B1 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PFIZER PROD INC (US) 2010-06-30 EP disclosed
US-7429665-B2 Heteroaromatic quinoline compounds PFIZER INC (US) 2008-09-30 US disclosed
US-20080214607-A1 HETEROAROMATIC QUINOLINE COMPOUNDS PFIZER INC 2008-09-04 US disclosed
EP-1841757-A2 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS Pfizer Products Incorporated (US) 2007-10-10 EP disclosed
US-20060154931-A1 Heteroaromatic quinoline compounds PFIZER INC 2006-07-13 US disclosed
WO-2006072828-A2 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2006-07-13 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 (2 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-20060154931-A1 Heteroaromatic quinoline compounds PDE12, PDE7A, PDE4A ALOX5 705/4885PDE10A 8/4885MEN1 1937/4885
US-20080214607-A1 HETEROAROMATIC QUINOLINE COMPOUNDS PDE12, PDE7A, PDE4A ALOX5 705/4885PDE10A 8/4885MEN1 1937/4885

“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.