SCHEMBL25565448

SCHEMBL25565448

CCCC1CCc2ccncc2N(C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 3/20 0.43
▸ CYP19A1 P11511 2/20 0.40
▸ HTR2A P28223 1/20 0.38
▸ HTR2C P28335 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ HDAC6 Q9UBN7 3/20 0.35
▸ DRD4 P21917 3/20 0.33
▸ DRD2 P14416 2/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM4 P08173 1/20 0.33
▸ CHRM5 P08912 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ CHRM3 P20309 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL25551278 0.79 HDAC6 (0.44) RIPK1CYP19A1HTR2AHTR2CHTR2B
SCHEMBL25554155 0.76 RIPK1 (0.45) RIPK1HTR2AHTR2CHTR2BADORA3
SCHEMBL19496039 0.70 CYP11B1 (0.55) CYP19A1ADORA3ADORA2ACYP3A4
SCHEMBL27390162 0.70 NPC1 (0.35) DRD4DRD2CHRM2CHRM4CHRM5
SCHEMBL25556119 0.68 CYP11B1 (0.46) CYP19A1ADORA3ADORA2AHDAC6CYP3A4
SCHEMBL15222076 0.66 HTR2A (0.46) HTR2AHTR2CHTR2BKDM4ECYP3A4
SCHEMBL12045381 0.66 ACVRL1 (0.43) CYP19A1ADORA3ADORA2ACYP3A4
SCHEMBL11923604 0.64 CHRNB2 (0.49) CYP19A1DRD2CYP3A4
SCHEMBL13125709 0.64 SIGMAR1 (0.40) CYP19A1HTR2AHTR2CHTR2BADORA3
SCHEMBL8279302 0.64 HTR2A (0.41) RIPK1HTR2AHTR2CHTR2BADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-25 — — US 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-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 RIPK1 1/4885CYP19A1 4476/4885HTR2A 3040/4885

“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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