SCHEMBL11501621

SCHEMBL11501621

C=Cc1cc(C(=C)c2ccccn2)ccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.39
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ NPC1 O15118 3/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ LMNA P02545 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ NAPRT Q6XQN6 1/20 0.37
▸ P4HTM Q9NXG6 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 3/20 0.34
▸ KDM6B O15054 1/20 0.34
▸ KDM4A O75164 1/20 0.34
▸ KDM5C P41229 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ KDM2A Q9Y2K7 1/20 0.34
▸ KDM3A Q9Y4C1 1/20 0.34

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
SCHEMBL2956362 0.76 CES2 (0.41) RAB9ACES2CES1KMT2ANPC1
SCHEMBL10824241 0.74 KMT2A (0.59) RAB9ACES2CES1KMT2ANPC1
SCHEMBL1408599 0.73 CES2 (0.58) RAB9ACES2CES1KMT2ANPC1
SCHEMBL168691 0.73 KDM4E (0.38) KMT2AMEN1LMNAL3MBTL1KDM4E
SCHEMBL3162890 0.72 SMN1; SMN2 (0.52) RAB9ACES2CES1KMT2ANPC1
SCHEMBL19857098 0.72 ALDH1A1 (0.47) RAB9ACES2CES1KMT2ANPC1
SCHEMBL9329315 0.72 MAPK1 (0.38) RAB9ACES2CES1KMT2ANPC1
Methyl Alcohol SCHEMBL28478481 0.71 ALDH1A1 (0.58) RAB9ACES2CES1KMT2ANPC1
SCHEMBL25236791 0.71 KMT2A (0.56) RAB9ACES1KMT2ANPC1MEN1
SCHEMBL7401799 0.71 NPC1 (0.53) RAB9ACES1KMT2ANPC1ALDH1A1

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-4152496-A HETEROGENEOUS ION EXCHANGE RESINS ROHM AND HAAS COMPANY (US) 1979-05-01 — — US disclosed
US-3991017-A Ion exchange resins derived from hybrid copolymers ROHM AND HAAS COMPANY (US) 1976-11-09 — — US disclosed
US-3966489-A Method of decolorizing sugar solutions with hybrid ion exchange resins ROHM AND HAAS COMPANY (US) 1976-06-29 — — US disclosed
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