SCHEMBL7923071

SCHEMBL7923071

Cc1cc2c(cn1)NC(C)C2

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.40
CHRNA7 P36544 1/20 0.37
AR P10275 2/20 0.36
PGR P06401 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
BRD4 O60885 4/20 0.35
CREBBP Q92793 3/20 0.35
TSHR P16473 1/20 0.33
EP300 Q09472 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
RAB9A P51151 1/20 0.32
UHRF1 Q96T88 1/20 0.31
MAP4K1 Q92918 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31

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
SCHEMBL7922408 0.87 NNMT (0.44) NNMTCHRNA7ARPGRLMNA
SCHEMBL14548031 0.80 CHRNB2 (0.40) NNMTARPGRLMNAGAA
SCHEMBL12965849 0.77 AR (0.45) NNMTARPGRLMNAGAA
SCHEMBL30681474 0.76 AR (0.45) NNMTARPGRLMNAGAA
SCHEMBL14144336 0.76 CHRNA7 (0.34) CHRNA7
SCHEMBL12965982 0.75 AR (0.44) NNMTARPGRLMNAGAA
SCHEMBL21131358 0.72 NNMT (0.37) NNMTCHRNA7LMNAGAAMAPT
SCHEMBL14401106 0.70 KMT2A (0.40) GAAMAPTRAB9ACYP1A2
SCHEMBL30101714 0.69 GAA (0.47) ARPGRLMNAGAAMAPT
SCHEMBL7922397 0.69 GAA (0.47) ARPGRLMNAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649062-B1 BICYCLIC COMPOUNDS AS INHIBITORS OF ACETYL-COA CARBOXYLASE (ACC) TAKEDA PHARMACEUTICAL (JP) 2015-04-08 EP disclosed
US-8729102-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-05-20 US disclosed
US-8729102-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-05-20 US disclosed
US-8501804-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-06 US disclosed
US-8501804-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-06 US disclosed
WO-2012074126-A9 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-06-06 WO disclosed
US-20120142714-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-06-07 US disclosed
US-20120142714-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-06-07 US disclosed
WO-2012074126-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-06-07 WO disclosed
US-20120010247-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-12 US disclosed
US-20120010247-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-12 US disclosed
EP-2351743-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-08-03 EP disclosed
WO-2010050445-A1 BICYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2010-05-06 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 (2 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-20120010247-A1 BICYCLIC COMPOUND ACACA, CPT1B, ACACB NNMT 995/4885CHRNA7 3011/4885AR 182/4885
US-20120142714-A1 BICYCLIC COMPOUND ACACA, ACACB, FABP4 NNMT 694/4885CHRNA7 3321/4885AR 827/4885

“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.