SCHEMBL29909509

SCHEMBL29909509

CN(c1cccc(-c2cnc(N3CCOCC3)nc2)c1)c1nc2nnc(Cl)n2c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 10/20 0.40
CNR2 P34972 3/20 0.38
PIK3R2 O00459 1/20 0.36
KCNH2 Q12809 2/20 0.35
MAPT P10636 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
GLA P06280 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CASP1 P29466 1/20 0.34
CYP2C19 P33261 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL29909545 0.89 PIK3R2 (0.38) AOC3CNR2PIK3R2MAPTLMNA
SCHEMBL29909383 0.85 CNR2 (0.38) AOC3CNR2KCNH2MAPTPIK3CD
SCHEMBL29909403 0.82 KCNH2 (0.34) CNR2PIK3R2KCNH2MAPTPIK3CA
SCHEMBL30961080 0.82 CNR2 (0.38) CNR2
SCHEMBL29909353 0.81 ABCG2 (0.37) MAPT
SCHEMBL29909079 0.81 ALDH1A1 (0.35) CNR2MAPTLMNAALDH1A1CYP1A2
SCHEMBL29909741 0.81 NPC1 (0.43) MAPT
SCHEMBL29909708 0.81 ABCG2 (0.41) MAPTALDH1A1
SCHEMBL29909705 0.80 ABCG2 (0.37)
SCHEMBL29909735 0.80 NTRK1 (0.40) CNR2KCNH2

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-12054490-B2 Diacylglycerol kinase modulating compounds GILEAD SCIENCES, INC. (US) 2024-08-06 US disclosed
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 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-12054490-B2 Diacylglycerol kinase modulating compounds DGKG, DGKB, DGKK AOC3 4703/4885CNR2 1348/4885PIK3R2 160/4885

“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.