SCHEMBL11207978

SCHEMBL11207978

COc1ccc(C(=O)Nc2nc3ccccc3[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 14/20 1.00
NPC1 O15118 13/20 1.00
PKM P14618 7/20 1.00
MEN1 O00255 3/20 1.00
KMT2A Q03164 3/20 1.00
SMN1; SMN2 Q16637 7/20 0.79
MAPT P10636 3/20 0.79
LMNA P02545 2/20 0.79
KLF5 Q13887 3/20 0.76
OPRK1 P41145 1/20 0.74
MAOB P27338 1/20 0.72
ADORA2A P29274 1/20 0.72
TP53 P04637 2/20 0.72
MTOR P42345 1/20 0.72
SCD O00767 1/20 0.70
KDM4E B2RXH2 1/20 0.70
HSD17B10 Q99714 1/20 0.70
USP2 O75604 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
RXFP1 Q9HBX9 1/20 0.67

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
SCHEMBL11703736 0.89 NPC1 (0.91) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL22193346 0.86 RAB9A (1.00) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL11706816 0.85 NPC1 (1.00) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL11702938 0.85 NPC1 (0.80) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL11703469 0.85 RAB9A (0.73) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL11703485 0.85 RAB9A (0.73) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL3926899 0.84 NPC1 (1.00) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL11733357 0.84 RAB9A (0.73) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL9728959 0.84 RAB9A (0.72) RAB9ANPC1PKMMEN1KMT2A
SCHEMBL29263343 0.84 RAB9A (0.76) RAB9ANPC1PKMMEN1KMT2A

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-0023889-B1 IMINOISOINDOLINONE METAL COMPLEXES, PROCESS FOR THEIR MANUFACTURE, METHOD FOR PIGMENTING AN ORGANIC HIGH-MOLECULAR MATERIAL AND HIGH-MOLECULAR ORGANIC MATERIAL CONTAINING SUCH A METAL COMPLEX CIBA-GEIGY AG (CH) 1983-03-09 EP disclosed
EP-0023889-A1 Iminoisoindolinone metal complexes, process for their manufacture, method for pigmenting an organic high-molecular material and high-molecular organic material containing such a metal complex CIBA-GEIGY AG (CH) 1981-02-11 EP disclosed
US-4011236-A N-(BENZIMIDAZOL-2-YL)ARYLCARBOXAMIDES AS ULTRAVIOLET (UV) LIGHT ABSORBERS MERCK & CO., INC. (US) 1977-03-08 US disclosed
US-4009164-A Novel 2-substituted-1,2,4-thiadiazole-[2,3-a]-benzimidazoles and process for their preparation SYNTEX (U.S.A.) INC. (US) 1977-02-22 US disclosed
US-3976654-A FUNGICIDE SYNTEX (U.S.A.) INC. (US) 1976-08-24 US disclosed
US-3946031-A FUNGICIDES SYNTEX INC. (US) 1976-03-23 US disclosed