SCHEMBL29236243

SCHEMBL29236243

Cc1ccc2c(c1C)C(Nc1ccc3ccccc3c1)c1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.36
PKLR P30613 1/20 0.36
ALDH1A1 P00352 5/20 0.34
CYP1A2 P05177 3/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP2C19 P33261 2/20 0.34
HIF1A Q16665 2/20 0.34
HPGD P15428 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 7/20 0.33
NPC1 O15118 6/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL17515219 0.83 KMT2A (0.38) ALDH1A1CYP1A2CYP3A4CYP2C19HPGD
SCHEMBL27957148 0.82 CYP1A2 (0.45) ALDH1A1CYP1A2CYP3A4HSD17B10HPGD
SCHEMBL28167211 0.81 KMT2A (0.35) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL29280562 0.79 ALDH1A1 (0.38) ALDH1A1HPGDMEN1KMT2ARAB9A
SCHEMBL29040922 0.79 CYP2A6 (0.42) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
SCHEMBL28044961 0.79 KMT2A (0.31) MEN1KMT2APOLBLMNA
SCHEMBL28307190 0.77 RAPGEF4 (0.36) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL27957155 0.72 NPC1 (0.45) ALDH1A1KMT2AKDM4ERAB9ANPC1
SCHEMBL19675665 0.67 GPR3 (0.36) ALDH1A1CYP1A2CYP3A4MEN1KMT2A
SCHEMBL29145678 0.67 HTR2A (0.36) CYP1A2MEN1KMT2APOLBCYP2A6

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
CN-118235072-A Optical film and polarizing plate 东曹株式会社 2024-06-21 CN disclosed