SCHEMBL2477516

SCHEMBL2477516

O=C(NCCc1ccc2ccccc2c1)N1CCC(c2ccc(O)cc2O)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.46
MCHR1 Q99705 1/20 0.45
DRD4 P21917 2/20 0.41
TPSAB1 Q15661 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
TGM2 P21980 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
CHRM4 P08173 3/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ASAH1 Q13510 1/20 0.40
FAAH O00519 1/20 0.40

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
SCHEMBL2475592 0.88 CHRM4 (0.48) TPSAB1ALDH1A1CHRM4
SCHEMBL2479412 0.82 GRM5 (0.45) TPSAB1POLBMAPTHTTCHRM4
SCHEMBL2474641 0.81 EPHX1 (0.45) ALDH1A1
SCHEMBL2480143 0.80 EPHX2 (0.43) ALDH1A1
SCHEMBL2473352 0.79 NPSR1 (0.58) KDM4EALDH1A1HRH3
SCHEMBL2474397 0.79 KMT2A (0.51) DRD4CHRM4
SCHEMBL2471885 0.77 EPHX2 (0.49) TPSAB1POLBHTTASAH1
SCHEMBL2471889 0.75 MEN1 (0.58) POLBPKM
SCHEMBL2474909 0.75 ALDH1A1 (0.56) TPSAB1ALDH1A1PKM
SCHEMBL2474149 0.75 GLA (0.53) ALDH1A1PKMHRH3

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-2373620-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2011-10-12 EP disclosed
WO-2010063774-A1 NOVEL 4-(AZACYCLOALKYL)BENZENE-1,3-DIOL COMPOUNDS AS TYROSINASE INHIBITORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-06-10 WO disclosed