SCHEMBL8095515

SCHEMBL8095515

CCC(C)Cc1cccc(C(=O)Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.41
FOLH1 Q04609 8/20 0.41
ANPEP P15144 1/20 0.41
ENPEP Q07075 1/20 0.41
GLRA1 P23415 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MEP1B Q16820 2/20 0.38
PNMT P11086 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
SCHEMBL8087560 0.88 FOLH1 (0.40) SLC7A5FOLH1ANPEPENPEPGLRA1
SCHEMBL13543995 0.85 FOLH1 (0.56) FOLH1ANPEPENPEPMEP1B
SCHEMBL9921264 0.85 FOLH1 (0.56) FOLH1ANPEPENPEPMEP1B
SCHEMBL8100962 0.85 SLC7A5 (0.42) SLC7A5FOLH1ANPEPENPEPMEP1B
SCHEMBL8094233 0.85 FOLH1 (0.40) SLC7A5FOLH1ANPEPENPEPGLRA1
SCHEMBL8094952 0.85 FOLH1 (0.46) SLC7A5FOLH1ANPEPENPEPGLRA1
SCHEMBL20222942 0.84 FOLH1 (0.51) SLC7A5FOLH1ANPEPENPEPMEP1B
SCHEMBL8093908 0.84 FOLH1 (0.41) SLC7A5FOLH1
SCHEMBL8095853 0.83 FOLH1 (0.40) FOLH1
SCHEMBL20257158 0.81 SLC7A5 (0.63) SLC7A5FOLH1ALDH1A1TSHR

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-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed