SCHEMBL24150596

SCHEMBL24150596

C#C[C@]1(O)CC[C@H](C)CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL11985367 1.00 ALDH1A1 (0.43) ALDH1A1CYP2C9CYP2C19
SCHEMBL7857566 0.79 ALDH1A1 (0.37) ALDH1A1
SCHEMBL926606 0.76 ALDH1A1 (0.36) ALDH1A1
SCHEMBL14808336 0.75 ALDH1A1 (0.50) ALDH1A1CYP2C9CYP2C19
SCHEMBL14357370 0.75 ALDH1A1 (0.44) ALDH1A1
SCHEMBL12859809 0.75 ALDH1A1 (0.35) ALDH1A1
SCHEMBL927482 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL130928 0.74
SCHEMBL15199621 0.74
SCHEMBL19321817 0.73 NR3C1 (0.31)

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-20230250064-A1 PREPARATION METHOD FOR FUSED PYRAZOLE-TYPE COMPOUND WUHAN CREATERNA SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-08-10 US disclosed
US-20230250064-A1 PREPARATION METHOD FOR FUSED PYRAZOLE-TYPE COMPOUND WUHAN CREATERNA SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-08-10 US disclosed
WO-2021259163-A1 PREPARATION METHOD FOR FUSED PYRAZOLE-TYPE COMPOUND 上海美悦生物科技发展有限公司 2021-12-30 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 (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-20230250064-A1 PREPARATION METHOD FOR FUSED PYRAZOLE-TYPE COMPOUND AZI2, HRH4, HRH2 ALDH1A1 382/4885CYP2C9 76/4885CYP2C19 19/4885

“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.