SCHEMBL11315258

SCHEMBL11315258

COc1ccc(NC(=S)Cc2ccccc2)cc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ESR1 P03372 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ LMNA P02545 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ POLB P06746 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ ADORA2A P29274 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ FPR2 P25090 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL11311778 0.89 MEN1 (0.52) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL11314927 0.84 KMT2A (0.70) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL11309845 0.81 MEN1 (0.46) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL11306216 0.79 ALDH1A1 (0.47) SMN1; SMN2KDM4EMEN1KMT2AALDH1A1
SCHEMBL11309066 0.78 POLB (0.53) RAB9ANPC1SMN1; SMN2KDM4EMEN1
SCHEMBL11694836 0.76 TP53 (0.57) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL11693812 0.76 HDAC1 (0.53) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL3462645 0.74 KMT2A (0.59) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL6809719 0.73 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EESR1
SCHEMBL11308885 0.73 MEN1 (0.74) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4263205-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1981-04-21 — — US disclosed
EP-0006154-A1 Monoazo pigments and their use in colouring high molecular-weight organic material CIBA-GEIGY AG (CH) 1980-01-09 — — EP disclosed
US-4062838-A LACQUERS, PRINTING INKS, YELLOW TO ORANGE CIBA-GEIGY CORPORATION (US) 1977-12-13 — — US disclosed
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