SCHEMBL4672007

SCHEMBL4672007

CCOC(=O)CC(C(=O)c1ccc(F)cc1)c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.42
MAPK14 Q16539 6/20 0.42
GCGR P47871 1/20 0.42
ALOX5 P09917 1/20 0.42
NAMPT P43490 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
CASP3 P42574 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
CXCR1 P25024 1/20 0.39
CXCR2 P25025 1/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL1598510 0.87 MEN1 (0.44) KMT2AMEN1LMNANPC1
SCHEMBL5781101 0.82 ALDH1A1 (0.40) ALOX5KMT2AMEN1MAPTCASP3
SCHEMBL5780142 0.81 EPHX2 (0.47) CYP2C9CYP2C19
SCHEMBL9071262 0.81 LTA4H (0.49) LTA4HMAPK14KMT2AMEN1MAPT
SCHEMBL5847575 0.81 SMN1; SMN2 (0.46) NAMPTMAPTLMNACYP1A2NPC1
SCHEMBL23587032 0.80 CYP2A6 (0.42) NAMPTMAPTLMNANPC1
SCHEMBL11740036 0.76 LMNA (0.53) KMT2AMEN1LMNANPC1
SCHEMBL7651890 0.76 MAPK14 (0.46) LTA4HMAPK14GCGRALOX5NAMPT
SCHEMBL24403590 0.76 KMT2A (0.46) KMT2AMAPTCXCR1CXCR2LMNA
SCHEMBL6934292 0.75 LTA4H (0.45) LTA4HMAPK14GCGRALOX5KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042293-B9 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC (US) 2008-09-03 EP disclosed
EP-1042293-B1 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC (US) 2008-03-19 EP disclosed
CN-1284945-A Substituted pyriding and pyridazine compounds and their pharmaceutical use AMGEN INC (US) 2001-02-21 CN disclosed
US-6174901-B1 FOR TREATMENT OF RHEUMATOID ARTHRITIS, PAGETS DISEASE, OSTEOPHOROSIS, MULTIPLE MYELOMA, UVEITITIS, ACUTE OR CHRONIC MYELOGENOUS LEUKEMIA, PANCREATIC .BETA. CELL DESTRUCTION, OSTEOARTHRITIS, RHEUMATOID SPONDYLITIS, GOUTY ARTHRITIS ETC. AMGEN INC. 2001-01-16 US disclosed
EP-1042293-A1 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE Amgen Inc. (US) 2000-10-11 EP disclosed
WO-1999032448-A1 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 1999-07-01 WO disclosed