SCHEMBL3272118

SCHEMBL3272118

Oc1ccc(-n2nccc2-c2ccncc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK9 P45984 3/20 0.59
▸ MAPK10 P53779 3/20 0.59
▸ MAPK8 P45983 1/20 0.50
▸ KDM5A P29375 1/20 0.44
▸ KDM4C Q9H3R0 1/20 0.44
▸ KDM5B Q9UGL1 1/20 0.44
▸ FLT3 P36888 3/20 0.41
▸ CYP17A1 P05093 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ NR3C2 P08235 5/20 0.40
▸ ENPP2 Q13822 1/20 0.38
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ CYP2C9 P11712 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ RPS6KA3 P51812 1/20 0.35

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
SCHEMBL15022988 0.82 MAPK9 (0.59) MAPK9MAPK10MAPK8KDM5AKDM4C
SCHEMBL25611895 0.82 FLT3 (0.61) MAPK9MAPK10MAPK8KDM5AKDM4C
SCHEMBL27315071 0.81 MAPK9 (0.68) MAPK9MAPK10MAPK8KDM5AKDM4C
SCHEMBL13734778 0.78 CHKA (0.56) MAPK9MAPK10MAPK8FLT3NR3C2
SCHEMBL15022318 0.78 MAPK9 (0.55) MAPK9MAPK10MAPK8FLT3NR3C2
SCHEMBL13734685 0.77 MAPK9 (0.54) MAPK9MAPK10MAPK8MEN1KMT2A
SCHEMBL15022076 0.75 MAPK9 (0.58) MAPK9MAPK10MAPK8KDM5AKDM4C
SCHEMBL13734515 0.74 MELK (0.57) MAPK9MAPK10MAPK8MEN1KMT2A
SCHEMBL15022987 0.74 MAPK9 (0.51) MAPK9MAPK10MAPK8FLT3NR3C2
SCHEMBL1628955 0.74 MEN1 (0.44) MAPK9MAPK10KDM5AKDM4CKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102491969-B Heteroaromatic quinoline compounds and the purposes as PDE10 inhibitor thereof PFIZER PRODUCTS INC. (US) 2015-08-19 — — CN disclosed
CN-102491969-A Heteroaromatic quinoline compounds PFIZER PROD INC 2012-06-13 — — CN disclosed
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
EP-1979343-A2 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS Pfizer Products Inc. (US) 2008-10-15 — — 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
CN-101098866-A Heteroaromatic quinoline compounds and their use as pde10 inhibitors PFIZER (US) 2008-01-02 — — CN disclosed
EP-1841757-A2 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS Pfizer Products Incorporated (US) 2007-10-10 — — EP disclosed
WO-2007077490-A2 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-07-12 — — WO disclosed
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2007-07-05 — — US 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 (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-20060154931-A1 Heteroaromatic quinoline compounds PDE12, PDE7A, PDE4A MAPK9 2386/4885MAPK10 534/4885MAPK8 2772/4885
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PDE12, PDE10A, PDE7A MAPK9 1574/4885MAPK10 220/4885MAPK8 1883/4885
US-20080214607-A1 HETEROAROMATIC QUINOLINE COMPOUNDS PDE12, PDE7A, PDE4A MAPK9 2386/4885MAPK10 534/4885MAPK8 2772/4885

“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.

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