SCHEMBL10690177

SCHEMBL10690177

CN(C)c1ccc(C2OC(=O)c3cc(N(C)C)ccc32)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAOB P27338 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
GALR2 O43603 1/20 0.35
NSD2 O96028 1/20 0.35
GAA P10253 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
SCHEMBL11073075 0.92 ALDH1A1 (0.46) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL11073520 0.91 ALDH1A1 (0.40) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL10441515 0.87 ALDH1A1 (0.38) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL339072 0.82 ALDH1A1 (0.47) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL9617635 0.81 ALDH1A1 (0.41) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL30422274 0.81 ALDH1A1 (0.41) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL11063311 0.81 ALDH1A1 (0.58) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL11073178 0.80 CA2 (0.43) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL11072148 0.80 KDM4E (0.36) ALDH1A1HPGDTDP1CYP3A4HIF1A
SCHEMBL9850351 0.79 ALDH1A1 (0.41) ALDH1A1HPGDTDP1CYP3A4HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4595768-A 3-(substituted phenyl)phthalides THE HILTON-DAVIS CHEMICAL CO. (US) 1986-06-17 US claimed
US-4732991-A Substituted phthalides HILTON DAVIS CHEMICAL CO. (US) 1988-03-22 US disclosed
US-4595768-A 3-(substituted phenyl)phthalides THE HILTON-DAVIS CHEMICAL CO. (US) 1986-06-17 US disclosed
US-4443614-A LEUCO DYES, PHTHALEIN DYES, INDICATORS KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1984-04-17 US disclosed
US-4439610-A FROM AMINES AND PHTHALIDES, MULTISTAGE KANZAKI PAPER MANUFACTURING COMPANY, LTD. (JP) 1984-03-27 US disclosed
US-4323700-A OXIDIZING 3-PHENYL PHTHACIDE PERIVATIVES KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1982-04-06 US disclosed
US-4045458-A FRIEDEL-CRAFTS CATALYSTS KANZAKI PAPER MANUFACTURING CO., LTD. (JA) 1977-08-30 US disclosed