SCHEMBL5699226

SCHEMBL5699226

c1ccc2c3c(ccc2c1)SNC3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP2A6 P11509 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HPRT1 P00492 1/20 0.38
LMNA P02545 1/20 0.37
HIF1A Q16665 1/20 0.35
CYP1B1 Q16678 1/20 0.35
KDM4E B2RXH2 3/20 0.35
CYP1A2 P05177 2/20 0.35
HPGD P15428 2/20 0.35
CYP2C19 P33261 2/20 0.35
GLA P06280 1/20 0.35
CYP2C9 P11712 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
HTT P42858 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
NCOA1 Q15788 1/20 0.35

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
SCHEMBL31712974 0.81 ALDH1A1 (0.38) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL31712924 0.79 ALDH1A1 (0.35) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL31712932 0.73 HSD17B10 (0.37) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL31712945 0.72 ALDH1A1 (0.35) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL9784311 0.69 HSD17B10 (0.46) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL2215560 0.67 KDM4E (0.38) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL926548 0.67 HSD17B10 (0.42) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL30726708 0.67 ALDH1A1 (0.44) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL14983740 0.67 ALDH1A1 (0.44) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL3076762 0.64 HSD17B10 (0.39) HSD17B10ALDH1A1CYP2A6TSHRTDP1

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
EP-1035435-B1 Photosensitive composition and 1,3-dihydro-1-oxo-2H-indene derivative FUJI PHOTO FILM CO LTD (JP) 2006-08-09 EP claimed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
EP-0415302-A2 Graft polymers with unsaturated side chains, light sensitive compositions containing them and coating composition with these polymers HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-06 EP disclosed