SCHEMBL25375899

SCHEMBL25375899

CCCc1ccc(-c2ccc(NCC(NC(=O)OC(C)(C)C)C(C)OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.40
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
CTSK P43235 3/20 0.39
CTSS P25774 3/20 0.39
PTPRB P23467 1/20 0.38
CA2 P00918 4/20 0.37
CA1 P00915 2/20 0.37
CA7 P43166 2/20 0.37
SDCBP O00560 1/20 0.36
SDC2 P34741 1/20 0.36
KLK5 Q9Y337 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
NAMPT P43490 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
ATM Q13315 1/20 0.35
CA4 P22748 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL25375897 1.00 CYP17A1 (0.40) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25376666 0.88 CA2 (0.44) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25376662 0.88 CA2 (0.44) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25378912 0.85 CCNE2 (0.44) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25378910 0.85 CCNE2 (0.44) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25377197 0.84 CTSK (0.43) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25377202 0.84 CTSK (0.43) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25377454 0.84 CTSK (0.43) CYP17A1ACACBACACACTSKCTSS
SCHEMBL25377331 0.82 MEN1 (0.43) CTSKCTSSCA2CA1CA7
SCHEMBL2522684 0.82 MEN1 (0.43) CTSKCTSSCA2CA1CA7

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-20250145561-A1 4-SUBSTITUTED-PHENYL ACETAMIDES AND ARYLUREAS AS AGONISTS FOR THE ORPHAN RECEPTOR GPR88 RESEARCH TRIANGLE INSTITUTE (US) 2025-05-08 US disclosed
EP-4469431-A1 4-SUBSTITUTED-PHENYL ACETAMIDES AND ARYLUREAS AS AGONISTS FOR THE ORPHAN RECEPTOR GPR88 Research Triangle Institute (US) 2024-12-04 EP disclosed
WO-2023146816-A1 4-SUBSTITUTED-PHENYL ACETAMIDES AND ARYLUREAS AS AGONISTS FOR THE ORPHAN RECEPTOR GPR88 RESEARCH TRIANGLE INSTITUTE (US) 2023-08-03 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-20250145561-A1 4-SUBSTITUTED-PHENYL ACETAMIDES AND ARYLUREAS AS AGONISTS FOR THE ORPHAN RECEPTOR GPR88 GPR88, GPR84, GPR139 CYP17A1 3587/4885ACACB 345/4885ACACA 412/4885

“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.