SCHEMBL23552654

SCHEMBL23552654

CC(=O)O/N=C(\c1ccc2c(c1)C(CC=C(C)C)(CC=C(C)C)c1cc(N)ccc1-2)c1ccccc1C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.33
▸ NPC1 O15118 4/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ SMN1; SMN2 Q16637 2/20 0.30

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
SCHEMBL18933437 0.87 NPC1 (0.34) RAB9ANPC1KMT2APOLBLMNA
SCHEMBL17877635 0.77 MAP2 (0.35) RAB9ANPC1KMT2APOLBMAPT
SCHEMBL17877629 0.76 MAP2 (0.34) RAB9ANPC1KMT2APOLBMAPT
SCHEMBL23552648 0.75 NPC1 (0.32) RAB9ANPC1KMT2APOLBLMNA
SCHEMBL23552876 0.74 KMT2A (0.33) RAB9ANPC1KMT2APOLBLMNA
SCHEMBL17877638 0.73 MAP2 (0.36) RAB9ANPC1KMT2APOLBMAPT
SCHEMBL23552933 0.73 RAB9A (0.32) RAB9AKMT2AHTT
SCHEMBL17056217 0.73 NPC1 (0.44) RAB9ANPC1KMT2APOLBLMNA
SCHEMBL18218064 0.73 NPC1 (0.44) RAB9ANPC1KMT2APOLBLMNA
SCHEMBL18123004 0.73 CNR2 (0.41) RAB9ANPC1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210191264-A1 NEGATIVE PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, AND ORGANIC EL DISPLAY AND MANUFACTURING METHOD THEREFOR TORAY INDUSTRIES, INC. (JP) 2021-06-24 — — US disclosed
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