SCHEMBL24721026

SCHEMBL24721026

CCc1cccc(-c2ccc(N3CCN(C(C)=O)CC3)nc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 2/20 0.61
▸ CKS1B P61024 1/20 0.52
▸ SKP1 P63208 1/20 0.52
▸ SKP2 Q13309 1/20 0.52
▸ FGFR3 P22607 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ DRD2 P14416 1/20 0.48
▸ DRD4 P21917 1/20 0.48
▸ AOC3 Q16853 2/20 0.48
▸ GRIN2B Q13224 4/20 0.47
▸ DPP4 P27487 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ TLR8 Q9NR97 1/20 0.46
▸ TLR7 Q9NYK1 1/20 0.46
▸ RET P07949 1/20 0.46
▸ RORC P51449 1/20 0.46
▸ MGLL Q99685 1/20 0.46

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
SCHEMBL23601155 0.85 DPP4 (0.63) WNT3ACKS1BSKP1SKP2FGFR3
SCHEMBL24721149 0.82 WNT3A (0.55) WNT3ACKS1BSKP1SKP2FGFR3
SCHEMBL12377892 0.82 AOC3 (0.62) WNT3ACKS1BSKP1SKP2AOC3
SCHEMBL13649187 0.77 HRH3 (0.60) KDRALDH1A1L3MBTL1RORCMGLL
SCHEMBL12303103 0.76 WNT3A (0.84) WNT3AAOC3
SCHEMBL1724668 0.76 WNT3A (1.00) WNT3AAOC3
SCHEMBL12650860 0.76 CKS1B (0.47) CKS1BSKP1SKP2DRD2DRD4
SCHEMBL23601160 0.75 GRM5 (0.50) WNT3AGRIN2BDPP4
SCHEMBL23601169 0.75 CKS1B (0.54) WNT3ACKS1BSKP1SKP2DRD2
SCHEMBL16603476 0.75 CNR2 (0.45) WNT3ACKS1BSKP1SKP2FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2022-10-13 — — US 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-20220324866-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK WNT3A 2896/4885CKS1B 329/4885SKP1 2207/4885

“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.

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