SCHEMBL9017641

SCHEMBL9017641

NC=CCc1cccc(O)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 1/20 0.42
ALDH1A1 P00352 1/20 0.42
EGFR P00533 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
LMNA P02545 1/20 0.42
FYN P06241 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
MMP8 P22894 1/20 0.42
CA6 P23280 1/20 0.42
CDK2 P24941 1/20 0.42
MMP12 P39900 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
IAPP P10997 4/20 0.42

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
SCHEMBL9744332 0.84 IAPP (0.50) ADAMTS4ALDH1A1EGFRCA1CA2
SCHEMBL9744335 0.84 IAPP (0.50) ADAMTS4ALDH1A1EGFRCA1CA2
SCHEMBL89100 0.83 TAAR1 (0.54) ALDH1A1EGFRCA2LMNAFYN
SCHEMBL11617674 0.80 CDK2 (0.36) ADAMTS4ALDH1A1EGFRCA1CA2
SCHEMBL9744460 0.76 PTGER4 (0.51) ALDH1A1ALOX15RECQLIAPPAPP
SCHEMBL9744465 0.76 PTGER4 (0.51) ALDH1A1ALOX15RECQLIAPPAPP
SCHEMBL666674 0.75 MAOB (0.38) TAAR1HSPA5
SCHEMBL346369 0.75 GABRA1 (0.70) ADAMTS4ALDH1A1EGFRCA1CA2
SCHEMBL2042101 0.75 IAPP (0.48) ADAMTS4ALDH1A1EGFRCA1CA2
SCHEMBL30817860 0.75 GABRA1 (0.70) ADAMTS4ALDH1A1EGFRCA1CA2

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
CN-104946244-B Detect O2·‑Fluorescent molecular probe, its synthetic method and application 中国科学院宁波材料技术与工程研究所 2017-08-25 CN disclosed
EP-0341808-B2 Process for coloring hair with aminoalkyl or aminohydroxyalkyl catechol compositions BRISTOL MYERS SQUIBB CO (US) 1996-12-18 EP disclosed
US-4904274-A Coloring hair with aminoalkyl-or aminohydroxyalkyl-catechols CLAIROL INCORPORATED (US) 1990-02-27 US disclosed