SCHEMBL18332153

SCHEMBL18332153

N#CCC(=O)c1cc2cc(OCC(F)F)c(Br)cc2[nH]1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 1/20 0.31
▸ SRD5A2 P31213 1/20 0.31
▸ ACACB O00763 2/20 0.31
▸ SYK P43405 1/20 0.30
▸ XDH P47989 2/20 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
SCHEMBL18332208 0.86 LMNA (0.37) SRD5A1SRD5A2
SCHEMBL18331842 0.82 SRD5A1 (0.30) SRD5A1SRD5A2
SCHEMBL20084181 0.82 SRD5A1 (0.36) SRD5A1SRD5A2SYKXDH
SCHEMBL18331896 0.82 GRIN2D (0.42) SRD5A1SRD5A2
SCHEMBL20085099 0.81 SRD5A1 (0.32) SRD5A1SRD5A2SYKXDH
SCHEMBL18332159 0.79 HRH3 (0.39) —
SCHEMBL20085009 0.78 SRD5A1 (0.32) SRD5A1SRD5A2SYKXDH
SCHEMBL21970583 0.78 SRD5A1 (0.36) SRD5A1SRD5A2SYKXDH
SCHEMBL18332146 0.78 KDM4E (0.52) XDH
SCHEMBL20084826 0.78 SYK (0.34) SRD5A1SRD5A2SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3312172-B1 AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2020-05-06 — — EP disclosed
EP-3312172-B1 AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2020-05-06 — — EP disclosed
US-10479780-B2 Aminopyrazole derivatives CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2019-11-19 — — US disclosed
US-20180362509-A1 AMINOPYRAZOLE DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2018-12-20 — — US disclosed
EP-3312172-A1 AMINOPYRAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 2018-04-25 — — EP disclosed
EP-3312172-A1 AMINOPYRAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 2018-04-25 — — EP disclosed
WO-2016204261-A1 AMINOPYRAZOLE DERIVATIVES 中外製薬株式会社 2016-12-22 — — 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 (2 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-10479780-B2 Aminopyrazole derivatives SRC, GRK2, GRK3 SRD5A1 1012/4885SRD5A2 1268/4885ACACB 2135/4885
US-20180362509-A1 AMINOPYRAZOLE DERIVATIVES SRC, GRK2, GRK3 SRD5A1 1012/4885SRD5A2 1268/4885ACACB 2135/4885

“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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