SCHEMBL7418316

SCHEMBL7418316

CCCCc1nc2ccc(C)cc2c(=O)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.68
KMT2A Q03164 2/20 0.54
MAPT P10636 2/20 0.52
HTT P42858 1/20 0.52
PARP14 Q460N5 1/20 0.52
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 0.48
TUBA4A P68366 2/20 0.48
TUBB4B P68371 2/20 0.48
TUBB3 Q13509 2/20 0.48
TUBB2A Q13885 2/20 0.48
TUBB8 Q3ZCM7 2/20 0.48
TUBA3E Q6PEY2 2/20 0.48
TUBA1A Q71U36 2/20 0.48
TUBA1C Q9BQE3 2/20 0.48
TUBB6 Q9BUF5 2/20 0.48
TUBB2B Q9BVA1 2/20 0.48
TUBB1 Q9H4B7 2/20 0.48

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
SCHEMBL17298077 0.85 TNKS2 (0.64) PARP1KMT2AMAPTPARP14TUBB4A
SCHEMBL9327417 0.84 PARP1 (0.66) PARP1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9130912 0.84 PARP1 (0.66) PARP1KMT2AMAPTTUBB4ATUBB
SCHEMBL13111952 0.84 PARP1 (0.66) PARP1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9376967 0.82 PARP1 (0.63) PARP1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL11376990 0.82 PARP1 (0.63) PARP1KMT2AMAPTTUBB4ATUBB
SCHEMBL7415916 0.82 PARP1 (0.63) PARP1MAPTPARP14TUBB4ATUBB
SCHEMBL31332096 0.82 PARP14 (0.56) PARP1KMT2AMAPTPARP14TUBB4A
SCHEMBL20339340 0.82 PARP1 (0.66) PARP1KMT2AMAPTHTTPARP14
SCHEMBL168776 0.81 PARP1 (1.00) PARP1KMT2ATNKS2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5789415-A Azacyclic-heterocyclic compounds as angiotension II receptor antagonists PFIZER INC. (US) 1998-08-04 US disclosed
US-5420133-A Quinazolinones substituted with phenoxyphenylacetic acid derivatives MERCK & CO., INC. (US) 1995-05-30 US disclosed
US-5401745-A Cardiovascular disorders or hypotensive agents MERCK & CO., INC. (US) 1995-03-28 US disclosed
WO-1995002596-A1 AZACYCLIC-HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN II RECEPTOR ANTAGONISTS PFIZER INC. (US) 1995-01-26 WO disclosed
WO-1994021259-A1 QUINAZOLINONES SUBSTITUTED WITH PHENOXYPHENYLACETIC ACID DERIVATIVES MERCK & CO., INC. (US) 1994-09-29 WO disclosed
US-5264439-A Quinazolinone, triazolinone and pyrimidinone angiotensin II antagonists incorporating a substituted benzyl element MERCK & CO., INC. (US) 1993-11-23 US disclosed
US-5252574-A Hypotensive agents, vision disorder MERCK & CO., INC. (US) 1993-10-12 US disclosed
EP-0510812-A1 Angiotensin II antagonists incorporating a substituted thiophene or furan MERCK & CO. INC. (US) 1992-10-28 EP disclosed