SCHEMBL9836932

SCHEMBL9836932

CCCNC(=O)COc1ccc(C2=NNC(=O)NC2C)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
HPGD P15428 4/20 0.43
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
USP2 O75604 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
SCHEMBL9835522 0.92 HPGD (0.45) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL9835976 0.90 SMN1; SMN2 (0.47) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL9837594 0.89 PDE3B (0.41) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL9836412 0.88 ALDH1A1 (0.51) HPGDLMNASMN1; SMN2RAB9AALDH1A1
SCHEMBL9834628 0.87 MAPT (0.43) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL10431228 0.86 ALDH1A1 (0.59) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL9835111 0.86 ALDH1A1 (0.53) LMNASMN1; SMN2BCHEACHEALDH1A1
SCHEMBL10475459 0.85 PDE3B (0.55) TSHRHPGDLMNASMN1; SMN2RAB9A
SCHEMBL9836476 0.84 TDP1 (0.48) TSHRPDE4APDE4BPDE4CPDE4D
SCHEMBL9835465 0.84 BCHE (0.49) TSHRLMNANPC1BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238357-B1 1,2,4-TRIAZINONE DERIVATIVES, THEIR PREPARATION AND USE Sankyo Company Limited (JP) 1991-05-29 EP claimed
US-4898862-A 1,2,4-triazinone derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1990-02-06 US claimed
EP-0238357-A2 1,2,4-Triazinone derivatives, their preparation and use Sankyo Company Limited (JP) 1987-09-23 EP claimed
US-4898862-A 1,2,4-triazinone derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1990-02-06 US disclosed
EP-0238357-A2 1,2,4-Triazinone derivatives, their preparation and use Sankyo Company Limited (JP) 1987-09-23 EP disclosed