SCHEMBL23123430

SCHEMBL23123430

CC1C(c2ccccc2)CCCN1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 2/20 0.50
▸ UTS2R Q9UKP6 4/20 0.45
▸ CNR2 P34972 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ HRH3 Q9Y5N1 6/20 0.43
▸ SIGMAR1 Q99720 2/20 0.43
▸ HSD11B1 P28845 1/20 0.42

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
SCHEMBL4613765 0.88 RIPK1 (0.48) RIPK1UTS2RCNR2POLBHRH3
SCHEMBL24700138 0.82 RIPK1 (0.52) RIPK1CNR2
SCHEMBL28188380 0.81 RIPK1 (0.47) RIPK1UTS2R
SCHEMBL4392356 0.78 UTS2R (0.49) RIPK1UTS2R
SCHEMBL17558248 0.76 RIPK1 (0.69) RIPK1HSD11B1
SCHEMBL1853141 0.76 RIPK1 (0.69) RIPK1HSD11B1
SCHEMBL1847627 0.76 RIPK1 (0.69) RIPK1HSD11B1
SCHEMBL23139723 0.76 RIPK1 (0.43) RIPK1UTS2RCNR2HRH3
SCHEMBL23124099 0.75 EPHX2 (0.67) HRH3
SCHEMBL5968844 0.72 RIPK1 (0.51) RIPK1POLBSIGMAR1

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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-01 — — US disclosed
WO-2021055630-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL- BIOTECH INVESTMENTS, INC. (US) 2021-03-25 — — 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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GBA2, CLN6 RIPK1 2840/4885UTS2R 2042/4885CNR2 12/4885

“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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