SCHEMBL8140296

SCHEMBL8140296

Cc1cccn1-c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.47
MGLL Q99685 1/20 0.44
FGFR1 P11362 1/20 0.44
IDO1 P14902 1/20 0.43
KDM4E B2RXH2 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
HTR3A P46098 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PKM P14618 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
MEN1 O00255 1/20 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
SCHEMBL8137135 0.78 KEAP1 (0.49) NOTUMMGLLGAAMAPTKMT2A
SCHEMBL5272522 0.78 BIRC5 (0.46) NOTUMKDM4EGAAMAPTKMT2A
SCHEMBL8139682 0.77 NOTUM (0.44) NOTUMGAAMAPTALDH1A1PKM
SCHEMBL2542214 0.77 MGLL (0.44) NOTUMMGLLFGFR1IDO1KMT2A
SCHEMBL12270200 0.77 KDM4E (0.32) KDM4EMAPTKMT2AALDH1A1MEN1
SCHEMBL8139141 0.76 NOTUM (0.51) NOTUMMGLLFGFR1ALDH1A1PKM
SCHEMBL11176499 0.75 POLB (0.63) KDM4EGAAMAPTKMT2AALDH1A1
SCHEMBL1127502 0.74 ATM (0.48) NOTUMFGFR1KDM4EGAAMAPT
SCHEMBL2222230 0.74 MGLL (0.50) NOTUMMGLLFGFR1IDO1KMT2A
SCHEMBL8139424 0.74 KDM4E (0.39) NOTUMMGLLFGFR1IDO1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP disclosed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 WO disclosed