SCHEMBL10241740

SCHEMBL10241740

Cc1cnc(C#C[Si](C)(C)C)c(C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRK1 P41145 1/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
KDM5A P29375 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
SCHEMBL21928132 0.83 CYP11B1 (0.38) CYP11B1CYP11B2KDM4ENPC1ALDH1A1
SCHEMBL2699377 0.80 CYP11B1 (0.37) CYP11B1CYP11B2KDM4ENPC1ALDH1A1
SCHEMBL9984177 0.79 CNR1 (0.39) CYP11B1CYP11B2OPRK1
SCHEMBL2698512 0.75 SRC (0.33)
SCHEMBL1150077 0.74 NOS3 (0.41) KDM4EALDH1A1SMN1; SMN2CCR1CCR5
SCHEMBL7215518 0.72 CHRNB2 (0.42) CYP11B1CYP11B2KDM4ENPC1ALDH1A1
SCHEMBL2019283 0.71 HPGD (0.39) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL28445576 0.70 CCR1 (0.32) ALDH1A1NPSR1CCR1CCR5CCR8
SCHEMBL1713842 0.70 NOS3 (0.50) CCR1CCR5CCR8NOS3NOS1
SCHEMBL18399944 0.70

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-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-05-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET CYP11B1 40/4885CYP11B2 32/4885KDM4E 4500/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.