SCHEMBL4642422

SCHEMBL4642422

O=C(Cl)C(Cl)c1ccccc1.O=C(Cl)COCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 1/20 0.41
GRM5 P41594 4/20 0.40
TACR1 P25103 2/20 0.40
PTPRC P08575 1/20 0.39
PTPN1 P18031 1/20 0.39
SLC1A1 P43005 1/20 0.38
AGTR2 P50052 2/20 0.38
RAB9A P51151 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL73270 0.85 ALDH1A1 (0.59) ALDH1A1TSHRNPC1MAPTGRM5
SCHEMBL9823813 0.78 CYP2D6 (0.48) ALDH1A1TSHRMAPT
SCHEMBL286907 0.78 CYP2D6 (0.48) ALDH1A1TSHRMAPT
SCHEMBL1173291 0.78 CYP2D6 (0.48) ALDH1A1TSHRMAPT
SCHEMBL343578 0.77 ALDH1A1 (0.53) ALDH1A1HTTSMN1; SMN2TSHRNPC1
SCHEMBL27733432 0.77 NR4A1 (0.57)
SCHEMBL4642836 0.75 SMN1; SMN2 (0.41) ALDH1A1HTTSMN1; SMN2TSHRNPC1
SCHEMBL4642834 0.74 HTT (0.40) ALDH1A1HTTSMN1; SMN2TSHRNPC1
SCHEMBL8698888 0.74 CYP2D6 (0.44) ALDH1A1TSHRMAPT
Hydrochloric Acid SCHEMBL8093613 0.74 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2TSHRNPC1MAPT

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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed