SCHEMBL21565748

SCHEMBL21565748

Cc1cc(CNC(=O)C(C)C)cc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 3/20 0.53
▸ ERCC1 P07992 1/20 0.47
▸ ERCC4 Q92889 1/20 0.47
▸ MTOR P42345 1/20 0.46
▸ CCR2 P41597 13/20 0.46
▸ MLYCD O95822 1/20 0.45

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
SCHEMBL20088472 0.86 TACR1 (0.49) TACR1MTORCCR2MLYCD
SCHEMBL20428059 0.84 ERCC1 (0.57) TACR1ERCC1ERCC4
SCHEMBL20088353 0.84 SCN9A (0.54) TACR1MTORCCR2
SCHEMBL20088440 0.84 SCN9A (0.50) TACR1MTORCCR2MLYCD
SCHEMBL20088471 0.84 SCN9A (0.54) TACR1MTORCCR2
SCHEMBL18251695 0.80 ERCC1 (0.50) ERCC1ERCC4
SCHEMBL20088438 0.79 TACR1 (0.49) TACR1MTORMLYCD
SCHEMBL25780517 0.79 MTOR (0.46) TACR1MTORCCR2MLYCD
SCHEMBL13103578 0.79 MLYCD (0.59) TACR1ERCC1ERCC4MLYCD
SCHEMBL18251700 0.78 ERCC1 (0.55) TACR1ERCC1ERCC4

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-20190343802-A1 CELL-PROTECTIVE COMPOUNDS AND THEIR USE ETH Zürich (CH) 2019-11-14 — — 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-20190343802-A1 CELL-PROTECTIVE COMPOUNDS AND THEIR USE SRPK2, SRSF2, SRPK1 TACR1 4188/4885ERCC1 1690/4885ERCC4 967/4885

“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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