SCHEMBL30464845

SCHEMBL30464845

O=COc1ccc(C2CC2)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 2/20 0.37
▸ NR1H4 Q96RI1 3/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ OPRL1 P41146 3/20 0.32
▸ ADAMTS5 Q9UNA0 2/20 0.32
▸ GRIA1 P42261 1/20 0.32
▸ CACNG8 Q8WXS5 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ SIGMAR1 Q99720 2/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.32
▸ EBP Q15125 1/20 0.32
▸ GRM5 P41594 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ CEL P19835 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31
▸ HPGD P15428 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
SCHEMBL27636008 0.79 STS (0.37) STSDPP4
SCHEMBL27996885 0.79 STS (0.40) STSDPP4
SCHEMBL28007547 0.79 STS (0.37) STSDPP4
SCHEMBL28694993 0.76 TAS1R3 (0.39) DPP4
SCHEMBL27484924 0.76 STS (0.37) STSDPP4
SCHEMBL95605 0.75 ALDH1A1 (0.46) ADAMTS5SLC6A2SLC6A4SLC6A3
SCHEMBL29782248 0.75 ALDH1A1 (0.46) ADAMTS5SLC6A2SLC6A4SLC6A3
SCHEMBL18519745 0.73 ALDH1A1 (0.55) OPRL1GRIA1CACNG8DGAT1SIGMAR1
SCHEMBL27682658 0.73 HTR2C (0.49) —
SCHEMBL28018280 0.72 GRIA1 (0.38) OPRL1GRIA1CACNG8SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2023-11-16 — — US disclosed
CN-116323624-A Quinazoline compound and application thereof 上海医药集团股份有限公司 2023-06-23 — — CN 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-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF KRAS, NRAS, BRAF STS 3339/4885NR1H4 1199/4885DPP4 2337/4885

“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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