SCHEMBL8446516

SCHEMBL8446516

CCOc1cc(F)nc(N)n1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ KMT2A Q03164 1/20 0.47
▸ NUDT1 P36639 3/20 0.42
▸ POLB P06746 1/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ CYP2C9 P11712 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL1576650 0.86 NPC1 (0.62) NPC1RAB9AALDH1A1MAPK1KMT2A
SCHEMBL9340477 0.85 KMT2A (0.45) NPC1RAB9AALDH1A1MAPK1KMT2A
SCHEMBL9340530 0.81 CDK1 (0.43) NPC1RAB9AALDH1A1MAPK1KMT2A
SCHEMBL17581241 0.80 KMT2A (0.44) NPC1RAB9AALDH1A1MAPK1KMT2A
SCHEMBL2800474 0.80 NPC1 (0.57) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL8630748 0.78 NPC1 (0.56) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL18134205 0.78 NUDT1 (0.66) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL10618233 0.78 NPC1 (0.51) NPC1RAB9AALDH1A1MAPK1NUDT1
SCHEMBL8448250 0.78 KMT2A (0.51) NPC1RAB9AALDH1A1KMT2ANUDT1
SCHEMBL17589003 0.78 HTR7 (0.46) KMT2ANUDT1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628031-B1 HERBICIDE N- (PYRIMIDIN-2-YL)AMINOCARBONYL] BENZENE SULPHONAMIDES BASF AG (DE) 1999-06-16 — — EP disclosed
US-5612286-A FLUORINE SUBSTITUTED HEERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-03-18 — — US disclosed
EP-0628031-A1 HERBICIDE N- (PYRIMIDIN-2-YL)AMINOCARBONYL] BENZENE SULPHONAMIDES BASF Aktiengesellschaft (DE) 1994-12-14 — — EP disclosed
EP-0378089-B1 Method for the preparation of 2-amino-4-fluoropyrimidine derivatives BASF AG (DE) 1994-06-29 — — EP disclosed
EP-0378092-B1 Herbicidal sulfonyl ureas, process for preparing them and their use BASF AG (DE) 1994-05-11 — — EP disclosed
WO-1993016998-A1 HERBICIDE N-[(PYRIMIDIN-2-YL)AMINOCARBONYL] BENZENE SULPHONAMIDES BASF AKTIENGESELLSCHAFT (DE) 1993-09-02 — — WO disclosed
US-5011927-A Preparation of 2-amino-4-fluoropyrimidine derivatives BASF AKTIENGESELLSCHAFT (DE) 1991-04-30 — — US disclosed
EP-0378089-A1 Method for the preparation of 2-amino-4-fluoropyrimidine derivatives BASF Aktiengesellschaft (DE) 1990-07-18 — — EP disclosed
EP-0378092-A1 Herbicidal sulfonyl ureas, process for preparing them and their use BASF Aktiengesellschaft (DE) 1990-07-18 — — EP disclosed
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