SCHEMBL14415978

SCHEMBL14415978

CC(C)CNCCc1cncn1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.41
HRH3 Q9Y5N1 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NAMPT P43490 2/20 0.35
IDO1 P14902 1/20 0.35
CHRM5 P08912 3/20 0.33
SLC40A1 Q9NP59 1/20 0.33
CHRM4 P08173 2/20 0.32
CHRM1 P11229 2/20 0.32
CYP2C9 P11712 2/20 0.32
CHRM3 P20309 2/20 0.32
LMNA P02545 2/20 0.32
CHRM2 P08172 1/20 0.32
CYP2A6 P11509 1/20 0.32
CNR1 P21554 1/20 0.32
HTR2A P28223 1/20 0.32
CYP2A13 Q16696 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL25455194 0.81 CHRM4 (0.37) HRH4HRH3CYP1A2CYP2C19NAMPT
SCHEMBL16812145 0.79 HRH4 (0.38) HRH4HRH3CYP1A2CYP2C19NAMPT
SCHEMBL4104460 0.77 TLR7 (0.38) CYP1A2CYP2C19CHRM5CHRM4CHRM1
SCHEMBL16812917 0.77 MEN1 (0.40) HRH4HRH3CYP1A2CYP2C19ALDH1A1
SCHEMBL14415977 0.77 NAMPT (0.35) CYP1A2CYP2C19NAMPTCHRM5CHRM4
SCHEMBL16373637 0.75 CHRM5 (0.36) CYP1A2CYP2C19NAMPTCHRM5CHRM4
SCHEMBL16310127 0.75 NAMPT (0.38) CYP1A2CYP2C19NAMPTCHRM5CHRM4
SCHEMBL14415982 0.74 CHRM5 (0.40) CYP1A2CYP2C19NAMPTCHRM5CHRM4
SCHEMBL16869544 0.74 CHRM5 (0.36) CYP1A2CYP2C19CHRM5CHRM4CHRM1
SCHEMBL14415976 0.73 CYP3A4 (0.52) HRH4CYP2C19IDO1CHRM2MEN1

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
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
WO-2007084498-A1 PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS SCHERING CORPORATION (US) 2007-07-26 WO 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-20070213340-A1 Farnesyl protein transferase inhibitors FNTB, FNTA, FDPS HRH4 2441/4885HRH3 3867/4885CYP1A2 1621/4885

“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.