SCHEMBL20008155

SCHEMBL20008155

CN/C=C(\C=C/CC1(C)CCC1)c1cc(C)ccc1C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 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
SCHEMBL20009414 0.63 MEN1 (0.33) MEN1KMT2A
SCHEMBL20008150 0.61 RAB9A (0.41) KMT2A
SCHEMBL26696562 0.60 P2RX7 (0.44) HSD17B10
SCHEMBL20009423 0.60 MEN1 (0.36) HSD17B10MEN1KMT2ATSHR
SCHEMBL20009422 0.60 MEN1 (0.33) HSD17B10MEN1KMT2ATSHR
Hydrochloric Acid SCHEMBL26613227 0.59 P2RX7 (0.43) HSD17B10
SCHEMBL18432558 0.59 MEN1 (0.36) HSD17B10MEN1KMT2ATSHR
SCHEMBL25724196 0.58 MEN1 (0.41) HSD17B10MEN1KMT2ATSHR
SCHEMBL18568450 0.57 MEN1 (0.53) MEN1KMT2ATSHR
SCHEMBL25644373 0.55 P2RX7 (0.42)

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed