SCHEMBL9799220

SCHEMBL9799220

CCc1ccccc1N(N)c1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.47
CLCN2 P51788 1/20 0.46
CYP2C9 P11712 1/20 0.42
HIF1A Q16665 1/20 0.42
FOLH1 Q04609 1/20 0.42
ALDH1A1 P00352 3/20 0.42
ALOX15 P16050 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ADRB2 P07550 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 2/20 0.39
HMGB1 P09429 1/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL14893324 0.86 ALDH1A1 (0.56) PTPN1ALDH1A1ALOX15KDM4ETSHR
SCHEMBL11444283 0.77 ALDH1A1 (0.55) PTPN1ALDH1A1ALOX15KDM4ETDP1
SCHEMBL28210206 0.77 PNMT (0.39) ALDH1A1GAAMAPT
Hydroxyamine SCHEMBL10695422 0.76 FOLH1 (0.57) CLCN2CYP2C9HIF1AFOLH1ALDH1A1
Methylamine SCHEMBL11526129 0.76 FOLH1 (0.57) CLCN2CYP2C9HIF1AFOLH1ALDH1A1
SCHEMBL28115 0.76 FOLH1 (0.61) CLCN2CYP2C9HIF1AFOLH1ALDH1A1
Ethylamine SCHEMBL11526670 0.74 FOLH1 (0.55) CLCN2CYP2C9HIF1AFOLH1ALDH1A1
SCHEMBL972143 0.74 ALDH1A1 (0.56) PTPN1ALDH1A1ALOX15KDM4ETDP1
SCHEMBL6914507 0.74 FOLH1 (0.59) CLCN2CYP2C9HIF1AFOLH1ALDH1A1
Ammonia Solution, Strong SCHEMBL22042013 0.74 FOLH1 (0.59) CLCN2CYP2C9HIF1AFOLH1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5008379-A Water soluble anionic dyes; lightfast brown color on leather SANDOZ LTD. (CH) 1991-04-16 US disclosed