SCHEMBL29909708

SCHEMBL29909708

CN(c1cccc(-c2ccc(F)nc2)c1)c1nc2nnc(Cl)n2c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.41
DHODH Q02127 2/20 0.34
PDE5A O76074 2/20 0.34
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ATM Q13315 1/20 0.32
CYP11B2 P19099 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
XBP1 P17861 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL29909353 0.90 ABCG2 (0.37) ABCG2DHODHPDE5ANPC1POLB
SCHEMBL29909741 0.89 NPC1 (0.43) ABCG2DHODHPDE5ANPC1POLB
SCHEMBL29909705 0.88 ABCG2 (0.37) ABCG2DHODHPDE5ANPC1POLB
SCHEMBL29909687 0.88 ABCG2 (0.37) ABCG2DHODHPDE5AATM
SCHEMBL29909758 0.88 ABCG2 (0.37) ABCG2DHODHPDE5A
SCHEMBL29909361 0.88 HSD17B1 (0.39) ABCG2PDE5AATM
SCHEMBL29909750 0.87 ABCG2 (0.36) ABCG2DHODHPDE5ANPC1POLB
SCHEMBL29909849 0.86 SCN9A (0.37) ABCG2ATMALDH1A1
SCHEMBL29909542 0.85 ABCG2 (0.34) ABCG2PDE5A
SCHEMBL30961080 0.85 CNR2 (0.38) ABCG2ATMKDM4E

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 ABCG2 4216/4885DHODH 1705/4885PDE5A 1924/4885

“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.