SCHEMBL30970985

SCHEMBL30970985

Cc1cc(C2(c3ccc(OCC4CO4)c(C)c3)c3ccccc3-c3ccccc32)ccc1OCC1CO1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
GLA P06280 1/20 0.55
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 3/20 0.40
HIF1A Q16665 2/20 0.40
CYP3A4 P08684 1/20 0.40
VDR P11473 1/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
PTPN1 P18031 1/20 0.36
MAPT P10636 4/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
OPRK1 P41145 1/20 0.36
PKM P14618 2/20 0.35
HPGD P15428 3/20 0.34

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
SCHEMBL20077674 1.00 ALDH1A1 (0.55) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL29385239 1.00 ALDH1A1 (0.55) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL1673410 1.00 ALDH1A1 (0.55) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL10756874 0.94 ALDH1A1 (0.49) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL10699374 0.94 ALDH1A1 (0.49) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL10695884 0.93 ALDH1A1 (0.48) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL15721348 0.92 ALDH1A1 (0.47) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL19223972 0.90 ALDH1A1 (0.45) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL30970984 0.90 ALDH1A1 (0.47) ALDH1A1GLAESR1ESR2TDP1
SCHEMBL12980275 0.90 ALDH1A1 (0.47) ALDH1A1GLAESR1ESR2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3888938-B1 RUBBERY COMPOSITION AND METHOD FOR PRODUCING SAME OSAKA GAS CO LTD (JP) 2026-01-07 EP disclosed
CN-112888579-B Rubber-like composition and method for producing same 大阪瓦斯株式会社 2024-07-09 CN disclosed