SCHEMBL7505072

SCHEMBL7505072

C[N]c1cnc(Cc2ccc(C#N)cc2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
LOXL2 Q9Y4K0 2/20 0.41
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2A6 P11509 2/20 0.40
TYMP P19971 1/20 0.39
BRS3 P32247 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
IDH1 O75874 1/20 0.35
AR P10275 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PLA2G10 O15496 1/20 0.35
PLA2G1B P04054 1/20 0.35
PLA2G2A P14555 1/20 0.35

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
SCHEMBL1507946 0.84 HRH3 (0.47) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL10588302 0.75 BRS3 (0.49) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL7505077 0.75 LOXL2 (0.49) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL6688212 0.75 TYMP (0.45) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL8498703 0.75 BRS3 (0.49) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL7129739 0.75 BRS3 (0.52) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL7468902 0.75 HRH3 (0.48) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL7843395 0.73 HRH3 (0.47) HRH3LOXL2MAPTRAB9ASMN1; SMN2
SCHEMBL8521874 0.73 HRH3 (0.43) HRH3LOXL2MAPTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6949148 0.73 HRH3 (0.47) HRH3LOXL2MAPTRAB9ASMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002057257-A1 CYCLO`C!AZEPANE DERIVATIVES WHICH ARE USED AS FARNESYLTRANSFERASE INHIBITORS AND METHOD FOR THE PREPARATION THEREFOR LES LABORATOIRES SERVIER (FR) 2002-07-25 WO claimed
US-20020156113-A1 Farnesyl transferase inhibitors; anticancer agents LES LABORATOIRES SERVIER (FR) 2002-10-24 US disclosed
WO-2002057257-A1 CYCLO`C!AZEPANE DERIVATIVES WHICH ARE USED AS FARNESYLTRANSFERASE INHIBITORS AND METHOD FOR THE PREPARATION THEREFOR LES LABORATOIRES SERVIER (FR) 2002-07-25 WO disclosed
WO-2002057258-A1 CYCLO`D!AZEPANE DERIVATIVES WHICH ARE USED AS FARNESYLTRANSFERASE INHIBITORS AND METHOD FOR THE PREPARATION THEREOF LES LABORATOIRES SERVIER (FR) 2002-07-25 WO disclosed
EP-1225170-A2 Cycloheptene compounds, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier S.A. (FR) 2002-07-24 EP 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-20020156113-A1 Farnesyl transferase inhibitors; anticancer agents COASY, FNTA, FNTB HRH3 3263/4885LOXL2 2884/4885MAPT 3382/4885

“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.