SCHEMBL27780684

SCHEMBL27780684

Cc1ccccc1OC(=O)c1ncc[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 1/20 0.42
▸ ATM Q13315 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL28896947 0.83 NPC1 (0.46) NPC1RAB9AKMT2APOLBATM
SCHEMBL28435056 0.82 HTR1A (0.42) NPC1RAB9AKMT2AATML3MBTL1
SCHEMBL30811376 0.82 KMT2A (0.41) NPC1RAB9AKMT2AL3MBTL1GLA
SCHEMBL11836426 0.78 KMT2A (0.47) NPC1RAB9AKMT2ATDP1GLA
SCHEMBL28436994 0.75 TAAR1 (0.41) NPC1RAB9AKMT2APOLBGLA
SCHEMBL2976001 0.75 NPC1 (0.59) NPC1RAB9AKMT2APOLBATM
SCHEMBL18631772 0.74 NPC1 (0.46) NPC1RAB9AKMT2APOLBTDP1
SCHEMBL7950844 0.73 KMT2A (0.51) NPC1RAB9AKMT2ARXRARXRB
SCHEMBL3711831 0.73 POLB (0.54) NPC1RAB9AKMT2APOLBL3MBTL1
SCHEMBL28358852 0.73 KMT2A (0.67) NPC1RAB9AKMT2AL3MBTL1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111094375-B Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学株式会社 2022-04-01 — — CN disclosed
CN-111094375-A Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学工业株式会社 2020-05-01 — — CN disclosed
CN-101665565-B Method for preparing polylactic acid by catalysis of carbene derivative NANJING UNIVERSITY OF TECHNOLOGY 2012-01-04 — — CN disclosed
CN-101665565-A Method for preparing polylactic acid by catalysis of carbene derivative NANJING UNIVERSITY OF TECHNOLOGY 2010-03-10 — — CN disclosed
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