SCHEMBL8669399

SCHEMBL8669399

CN(C(=O)C(N)CS)C1N=C(c2ccccc2F)c2cc(Cl)ccc2N(C[C]=O)C1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HTR1A P08908 1/20 0.41
DRD3 P35462 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR3A P46098 1/20 0.41
KCNH2 Q12809 1/20 0.41
GHSR Q92847 1/20 0.41
TRPV1 Q8NER1 3/20 0.40
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
CCKBR P32239 3/20 0.38
CCKAR P32238 2/20 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
SCHEMBL8672710 0.92 PDE4D (0.46) LMNAMAPTOPRK1TP53CCKBR
SCHEMBL8669230 0.90 HTR2B (0.45) LMNAMAPTOPRK1KCNH2TP53
SCHEMBL8801708 0.82 FNTA (0.49) LMNAPOLBMAPTTP53CCKBR
SCHEMBL8667954 0.81 CCKBR (0.48) KCNH2TP53CCKBRCCKAR
SCHEMBL8674133 0.81 CCKBR (0.48) KCNH2TP53CCKBRCCKAR
SCHEMBL8669346 0.78 HTR2B (0.41) LMNAMAPTOPRK1KCNH2TP53
SCHEMBL8670231 0.77 OPRK1 (0.57) LMNAOPRK1KCNH2CCKBRCCKAR
SCHEMBL8670227 0.77 HTR2B (0.49) LMNAMAPTOPRK1KCNH2TP53
SCHEMBL8674051 0.76 HTR2B (0.42) LMNAPOLBMAPTOPRK1KCNH2
SCHEMBL8674481 0.76 HTR2B (0.45) LMNAMAPTOPRK1KCNH2TP53

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-5843941-A Ras farnesyl transferase inhibitors GENENTECH, INC. (US) 1998-12-01 US disclosed