SCHEMBL7637320

SCHEMBL7637320

CCCCCCCCCCCCCCCCCCN(C)C(=O)c1ccccc1CO.CCCCCCCCCCCCCCCCCCN(C)C(=O)c1ccccc1COCCCCN(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 11/20 0.43
THRB P10828 10/20 0.43
TSHR P16473 3/20 0.41
CYP1A2 P05177 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 2/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
CHRM2 P08172 1/20 0.38
ADRA2A P08913 1/20 0.38
MAPT P10636 1/20 0.38
OPRK1 P41145 1/20 0.38
HTR2B P41595 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KMT2A Q03164 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
SCHEMBL8204132 0.96 TSHR (0.44) THRATHRBTSHRCYP1A2GAA
SCHEMBL7634705 0.87 TSHR (0.42) THRATHRBTSHRCYP1A2GAA
SCHEMBL7634558 0.86 TSHR (0.51) TSHRCYP1A2GAAHPGDLMNA
SCHEMBL7639416 0.86 TSHR (0.51) TSHRCYP1A2GAAHPGDLMNA
SCHEMBL7638368 0.84 THRB (0.43) THRATHRBALDH1A1KDM4E
SCHEMBL7641083 0.81 LMNA (0.43) THRATHRBTSHRCYP1A2GAA
SCHEMBL7634258 0.81 POLR1A (0.45) TSHRCYP1A2GAAHPGDLMNA
SCHEMBL7637361 0.80 HTT (0.50) THRATHRBTSHRHPGDALDH1A1
SCHEMBL8205114 0.79 KDM4E (0.45) THRATHRBCYP1A2ALDH1A1MAPK1
SCHEMBL8194371 0.78 DNM1 (0.42) THRATHRBTSHRCYP1A2GAA

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-0911320-B1 1,2-Di-substituted benzenecarboxamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO LTD (JP) 2002-07-24 EP disclosed
EP-0911320-A2 1,2-Di-substituted benzenecarboxamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO COMPANY LIMITED (JP) 1999-04-28 EP disclosed