SCHEMBL1674658

SCHEMBL1674658

COc1nc(C)c(N)cc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.37
CYP3A4 P08684 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
POLB P06746 2/20 0.37
RECQL P46063 2/20 0.35
TERT O14746 1/20 0.34
MAPT P10636 1/20 0.34
CASP1 P29466 1/20 0.34
GAA P10253 2/20 0.33
AURKA O14965 1/20 0.33
TTK P33981 1/20 0.33
AURKB Q96GD4 1/20 0.33
INCENP Q9NQS7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CD44 P16070 1/20 0.33
GFER P55789 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 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
SCHEMBL31345511 1.00 PIK3CA (0.37) PIK3CACYP3A4TSHRMAPK1POLB
SCHEMBL11993969 0.84 PIK3CA (0.41) PIK3CACYP3A4TSHRPOLBRECQL
SCHEMBL21372397 0.83 CYP3A4 (0.37) PIK3CACYP3A4TSHRMAPK1POLB
SCHEMBL38665916 0.83 PIK3CA (0.41) PIK3CACYP3A4TSHRMAPK1POLB
SCHEMBL215544 0.83 PIK3CA (0.41) PIK3CACYP3A4TSHRMAPK1POLB
SCHEMBL22833318 0.81 PIK3CA (0.44) PIK3CAMAPTCASP1
SCHEMBL15339519 0.79 RECQL (0.38) POLBRECQLMAPTGAAALDH1A1
SCHEMBL1674716 0.78 BRAF (0.36) CYP3A4TSHRMAPK1POLBMAPT
SCHEMBL29939860 0.76 P2RX7 (0.36) CYP3A4TSHRMAPK1TERT
SCHEMBL1559757 0.76 P2RX7 (0.36) CYP3A4TSHRMAPK1TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4536673-A1 CHEMICAL COMPOUNDS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2025-04-16 EP disclosed
US-20230416287-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-12-28 US disclosed
WO-2023238064-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-12-14 WO disclosed
US-11001569-B2 6-membered heteroaromatic substituted cyanoindoline derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-05-11 US disclosed
WO-2017125534-A1 NEW 6-MEMBERED HETEROAROMATIC SUBSTITUTED CYANOINDOLINE DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-07-27 WO disclosed
US-8436000-B2 Substituted carbamate derivatives as modulators of corticotropin-releasing factor receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2013-05-07 US disclosed
EP-2307024-B1 SUBSTITUTED CARBAMATE DERIVATIVES AS MODULATORS OF CORTICOTROPIN-RELEASING FACTOR RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2013-01-09 EP disclosed
US-20110124662-A1 Substituted Carbamate Derivatives as Modulators of Corticotropin-Releasing Factor Receptor Activity BRISTOL-MYERS SQUIBB COMPANY 2011-05-26 US disclosed
EP-2307024-A1 SUBSTITUTED CARBAMATE DERIVATIVES AS MODULATORS OF CORTICOTROPIN-RELEASING FACTOR RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2011-04-13 EP disclosed
WO-2010014687-A1 SUBSTITUTED CARBAMATE DERIVATIVES AS MODULATORS OF CORTICOTROPIN-RELEASING FACTOR RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-04 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 (3 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-20110124662-A1 Substituted Carbamate Derivatives as Modulators of Corticotropin-Releasing Factor Receptor Activity CRH, CRHR1, CRHR2 PIK3CA 2987/4885CYP3A4 3580/4885TSHR 67/4885
US-11001569-B2 6-membered heteroaromatic substituted cyanoindoline derivatives as NIK inhibitors NFKBIA, MAP3K14, IKBKG PIK3CA 422/4885CYP3A4 3245/4885TSHR 4112/4885
US-20230416287-A1 Chemical Compounds SCN8A, TRPV1, SCN10A PIK3CA 752/4885CYP3A4 2294/4885TSHR 4619/4885

“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.