SCHEMBL27420117

SCHEMBL27420117

CC(C)(C)C1NCCc2cccnc21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.38
FNTB P49356 3/20 0.38
RECQL P46063 1/20 0.36
CYP2D6 P10635 6/20 0.36
CXCR4 P61073 6/20 0.36
PRCP P42785 3/20 0.36
CYP3A4 P08684 1/20 0.34

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
SCHEMBL1011519 0.78 RECQL (0.39) FNTAFNTBRECQLCYP2D6CXCR4
SCHEMBL31569336 0.78 RECQL (0.39) FNTAFNTBRECQLCYP2D6CXCR4
SCHEMBL24317427 0.74 CXCR4 (0.42) FNTAFNTBRECQLCYP2D6CXCR4
SCHEMBL24019184 0.74 PRCP (0.58) FNTAFNTBRECQLCYP2D6CXCR4
SCHEMBL13783357 0.73 PRCP (0.56) RECQLPRCP
SCHEMBL19223482 0.73 PRCP (0.56) RECQLPRCP
SCHEMBL5021308 0.71 OPRL1 (0.35) FNTAFNTBCYP2D6CXCR4CYP3A4
SCHEMBL5021310 0.71 OPRL1 (0.35) FNTAFNTBCYP2D6CXCR4CYP3A4
SCHEMBL5021309 0.71 OPRL1 (0.35) FNTAFNTBCYP2D6CXCR4CYP3A4
SCHEMBL21672474 0.70

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-20240217990-A1 THIENOPYRROLE COMPOUNDS GILEAD SCIENCES, INC. 2024-07-04 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-20240217990-A1 THIENOPYRROLE COMPOUNDS SSB, TPMT, LCP2 FNTA 2673/4885FNTB 4191/4885RECQL 765/4885

“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.