SCHEMBL10490945

SCHEMBL10490945

O=C1c2c(O)cccc2C(c2cccc(O)c2)c2cccc(O)c21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
ALOX15 P16050 2/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAOA P21397 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
MAOB P27338 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.41
CYP3A4 P08684 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
HPN P05981 1/20 0.41
ALOX5 P09917 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL9421974 0.84 ALDH1A1 (0.47) ALDH1A1MAPTALOX15TSHRHSD17B10
SCHEMBL10490953 0.80 KDM1A (0.41) MAPT
SCHEMBL10490943 0.80 HDAC4 (0.47) ALDH1A1TSHRHSD17B10HPGDMAPK1
SCHEMBL17401225 0.75 HTR2A (0.41) ALDH1A1MAPTHSD17B10HPGDLMNA
SCHEMBL12251168 0.74 ALDH1A1 (0.45) ALDH1A1MAPTHSD17B10TDP1HPGD
SCHEMBL14113261 0.74 MAOA (0.56) ALDH1A1MAPTALOX15TSHRHSD17B10
SCHEMBL10490941 0.73 NPC1 (0.47) MAPTMAOAHPGDSMN1; SMN2
SCHEMBL10490934 0.72 ALDH1A1 (0.55) ALDH1A1MAPTALOX15TSHRHSD17B10
SCHEMBL14008637 0.72 MAOA (0.39) ALDH1A1MAPTALOX15TSHRHSD17B10
SCHEMBL8559808 0.71 ALDH1A1 (0.52) ALDH1A1MAPTALOX15TSHRHSD17B10

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
US-4843097-A ANTITUMOR AGENTS, SKIN DISORDERS, ANTIINFLAMMATORY AGENTS GROUPEMENT D'INTERET ECONOMIQUE DIT: CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-06-27 US claimed
US-4889865-A COSMETICS, SKIN DISORDERS, ANTICARCINOGENIC AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-12-26 US disclosed
US-4843097-A ANTITUMOR AGENTS, SKIN DISORDERS, ANTIINFLAMMATORY AGENTS GROUPEMENT D'INTERET ECONOMIQUE DIT: CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-06-27 US disclosed