SCHEMBL26076103

SCHEMBL26076103

CCC(C)(C)c1ccc(C)nc1C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.38
CCR1 P32246 1/20 0.34
RAB9A P51151 1/20 0.34
CCR5 P51681 1/20 0.34
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PDE2A O00408 1/20 0.31
CYP1A2 P05177 1/20 0.30
S1PR4 O95977 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
SCHEMBL21207640 0.81 SSTR4 (0.38) SSTR4CCR1RAB9ACCR5
SCHEMBL11955219 0.78 SSTR4 (0.41) SSTR4CCR1RAB9ACCR5KDM4E
SCHEMBL24198889 0.77 APOBEC3A (0.41) CCR1RAB9ACCR5KDM4EALDH1A1
SCHEMBL26354510 0.74 ALDH1A1 (0.46) RAB9AKDM4EALDH1A1
SCHEMBL3231080 0.74 SSTR4 (0.40) SSTR4CCR1RAB9ACCR5KDM4E
SCHEMBL19687547 0.72 SSTR4 (0.35) SSTR4
SCHEMBL13865687 0.71 RAB9A (0.39) SSTR4CCR1RAB9ACCR5ALDH1A1
SCHEMBL13463113 0.71 SSTR4 (0.48) SSTR4CCR1RAB9ACCR5CYP1A2
SCHEMBL3741710 0.71 SSTR4 (0.39) SSTR4KDM4EALDH1A1
SCHEMBL22547851 0.70 SSTR4 (0.35) SSTR4

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-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ABM THERAPEUTICS CORP (US) 2023-09-28 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-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ERBB2, ERBB3, ERBB4 SSTR4 1683/4885CCR1 1959/4885RAB9A 1217/4885

“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.