SCHEMBL3920487

SCHEMBL3920487

O=c1c(-c2ccc(O)c(F)c2)cncn1Cc1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C9 P11712 3/20 0.43
MAPK1 P28482 3/20 0.43
CYP2C19 P33261 3/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
BLM P54132 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR35 Q9HC97 1/20 0.40
PTGER3 P43115 2/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
PDE4B Q07343 1/20 0.39
GPBAR1 Q8TDU6 1/20 0.39

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
SCHEMBL3913554 0.90 LMNA (0.42) TSHRSMN1; SMN2POLBALDH1A1KDM4E
SCHEMBL3920670 0.88 MAPT (0.42) CYP1A2CYP3A4CYP2C9MAPK1CYP2C19
SCHEMBL3920808 0.87 SMN1; SMN2 (0.43) CYP3A4CYP2C9CYP2C19TSHRMEN1
SCHEMBL3913436 0.86 HSP90AA1 (0.44) USP2CYP1A2CYP3A4CYP2C9MAPK1
SCHEMBL3913668 0.85 ACLY (0.38) CYP1A2CYP3A4CYP2C9MAPK1CYP2C19
SCHEMBL3112868 0.83 VEGFA (0.44) CYP3A4MEN1KMT2ANPSR1ALDH1A1
SCHEMBL3923792 0.83 SMN1; SMN2 (0.41) CYP3A4MAPK1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL3921612 0.82 CHRM1 (0.38) CYP3A4PDE4BMIF
SCHEMBL3911329 0.82 CYP11B1 (0.46) USP2CYP1A2CYP3A4CYP2C9MAPK1
SCHEMBL3924211 0.82 EGLN1 (0.51) MAPK1MEN1KMT2ASMN1; SMN2POLB

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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 US disclosed
EP-2032538-A2 QUINOLINE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2009-03-11 EP disclosed
WO-2007146824-A2 QUINOLINE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-12-21 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 (1 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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 USP2 3385/4885CYP1A2 161/4885CYP3A4 319/4885

“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.