SCHEMBL9650992

SCHEMBL9650992

Cc1c(O)c(C)c(Cl)c(C)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.36
CHRM1 P11229 1/20 0.36
ALOX15 P16050 1/20 0.36
MAOA P21397 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
CASP1 P29466 1/20 0.33
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.30

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
SCHEMBL2869098 0.87 HPGD (0.37) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL10577820 0.86 TSHR (0.50) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL13176704 0.86 HPGD (0.41) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL24462646 0.83 HPGD (0.39) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL16379922 0.83 HPGD (0.39) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL17490271 0.81 HPGD (0.44) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL5587483 0.81 HPGD (0.44) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL1004841 0.80 CYP3A4 (0.32) ALDH1A1MAPTMEN1KMT2ACYP3A4
SCHEMBL2050463 0.80 HPGD (0.37) HPGDTSHRHSD17B10ALDH1A1MAPT
SCHEMBL11060919 0.80 HPGD (0.37) HPGDTSHRHSD17B10ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0243869-B1 PROCESS FOR THE PREPARATION OF DI-ORTHO-SUBSTITUTED DI-META-HALOGENATED PARA-HALOMETHYLPHENOLS THE DOW CHEMICAL COMPANY (US) 1992-06-17 EP disclosed
US-4740636-A Di-ortho-substituted di-meta-halogenated para-halomethylphenols THE DOW CHEMICAL COMPANY (US) 1988-04-26 US disclosed
EP-0243869-A2 Process for the preparation of di-ortho-substituted di-meta-halogenated para-halomethylphenols THE DOW CHEMICAL COMPANY (US) 1987-11-04 EP disclosed
US-4684752-A HALOGENATION THE DOW CHEMICAL COMPANY (US) 1987-08-04 US disclosed