SCHEMBL9250804

SCHEMBL9250804

COc1ccccc1NC(=O)Oc1cc2ccccc2cc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.58
MEN1 O00255 4/20 0.58
POLB P06746 4/20 0.58
MAPT P10636 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
KDM4E B2RXH2 1/20 0.53
MCL1 Q07820 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
PPARG P37231 1/20 0.51
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50
TUBB4B P68371 1/20 0.50
TUBB3 Q13509 1/20 0.50
TUBB2A Q13885 1/20 0.50
TUBB8 Q3ZCM7 1/20 0.50
TUBA3E Q6PEY2 1/20 0.50

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
SCHEMBL9621747 0.89 KMT2A (0.70) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL9253543 0.88 PPARG (0.65) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL9621995 0.86 PPARG (0.69) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL10437772 0.85 NPC1 (0.58) KMT2APOLBMAPTSMN1; SMN2KDM4E
SCHEMBL9622065 0.84 KMT2A (0.53) KMT2AMEN1POLBMAPTKDM4E
SCHEMBL10352865 0.83 KDM4E (0.62) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL10352019 0.83 KDM4E (0.69) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL9621986 0.82 TRPV1 (0.58) KMT2AMEN1MAPTKDM4ERAB9A
SCHEMBL10437858 0.82 RAB9A (0.52) KMT2AMEN1POLBMAPTSMN1; SMN2
SCHEMBL10352196 0.81 MEN1 (0.57) KMT2AMEN1POLBMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0391264-B1 Reactive dyes with two or three halogen-N-heterocycles as reactive groups BASF AG (DE) 1995-01-18 EP disclosed
EP-0352682-B1 Twice reactive dyes and benzyl compounds as their intermediary products BASF AG (DE) 1994-02-02 EP disclosed
EP-0391264-A1 Reactive dyes with two or three halogen-N-heterocycles as reactive groups BASF Aktiengesellschaft (DE) 1990-10-10 EP disclosed
EP-0300390-B1 TRIFLUOROMETHYL-ALKOXY-ANILIN, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE ICE-COLOUR TECHNIQUE HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-29 EP disclosed
EP-0362725-A1 Process for producing water insoluble azo dyes on the fibre according to the ice-colour technique HOECHST AKTIENGESELLSCHAFT (DE) 1990-04-11 EP disclosed
EP-0352682-A2 Twice reactive dyes and benzyl compounds as their intermediary products BASF Aktiengesellschaft (DE) 1990-01-31 EP disclosed
EP-0307817-A1 Double reacting dyes and benzyl sulfonyl intermediates BASF Aktiengesellschaft (DE) 1989-03-22 EP disclosed
EP-0119441-B1 REACTIVE DYES WITH SUBSTITUTED 4-FLUOROPYRIDAZ-6-ONE GROUPS BASF Aktiengesellschaft (DE) 1987-02-25 EP disclosed
EP-0133270-A1 Reactive dyes BASF Aktiengesellschaft (DE) 1985-02-20 EP disclosed
EP-0119441-A2 Reactive dyes with substituted 4-fluoropyridaz-6-one groups BASF Aktiengesellschaft (DE) 1984-09-26 EP disclosed
EP-0031099-B1 COMPOUNDS WITH REACTIVE RESTS AND THEIR USE IN DYEING FIBRES BASF Aktiengesellschaft (DE) 1984-07-18 EP disclosed
EP-0057418-A1 Nitro-aniline preparations HOECHST AKTIENGESELLSCHAFT (DE) 1982-08-11 EP disclosed
EP-0031099-A2 Compounds with reactive rests and their use in dyeing fibres BASF Aktiengesellschaft (DE) 1981-07-01 EP disclosed