SCHEMBL27171024

SCHEMBL27171024

CC1=Cc2c(cc3c(c2-c2ccccc2)CCC3)C1.CC1=Cc2cc3c(c(-c4ccccc4)c2C1)CCC3

nearest known ligand 0.31

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.31
FPR1 P21462 1/20 0.31
BRD4 O60885 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
MYC P01106 1/20 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
SCHEMBL3693341 0.92 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
SCHEMBL29776024 0.92 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
SCHEMBL29596409 0.91 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
SCHEMBL3697443 0.91 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
SCHEMBL28723735 0.90 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
Lithium SCHEMBL29767634 0.90 BRD4 (0.35) HSD17B10FPR1BRD4KDM4EALDH1A1
SCHEMBL27171020 0.87 FGF23 (0.30)
SCHEMBL5792605 0.87 MEN1 (0.36) HSD17B10BRD4KDM4EALDH1A1CYP1A2
SCHEMBL27171021 0.84
SCHEMBL27171026 0.83

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-20240084056-A1 Polyolefin-Based Ionomers and Production Thereof EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-03-14 US disclosed