SCHEMBL2548035

SCHEMBL2548035

COCc1nc(N(C[C@H](Cc2ccc(C(C)(F)F)nc2)NC(=O)OC(C)(C)C)C(=O)O)sc1Br

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
PTPRB P23467 2/20 0.33
AAK1 Q2M2I8 4/20 0.32
CYP3A4 P08684 8/20 0.32
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
PTPN1 P18031 2/20 0.31
AKT1 P31749 1/20 0.31
MLYCD O95822 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
SCHEMBL2548038 1.00 ATM (0.33) ATMPTPRBAAK1CYP3A4CTSS
SCHEMBL2544461 0.94 PTPRB (0.33) ATMPTPRBAAK1PTPN1
SCHEMBL2547847 0.84 PTPN1 (0.31) PTPN1
SCHEMBL2547843 0.84 PTPN1 (0.31) PTPN1
SCHEMBL2544463 0.84 CA1 (0.33)
SCHEMBL12277487 0.83 PTPRB (0.34) ATMPTPRBAAK1CYP3A4CTSS
SCHEMBL12241522 0.82 MLYCD (0.31) MLYCD
SCHEMBL2545442 0.82 ATM (0.37) ATMPTPRBAAK1CYP3A4CTSS
SCHEMBL2545438 0.82 ATM (0.37) ATMPTPRBAAK1CYP3A4CTSS
SCHEMBL2549204 0.81 ATM (0.33) ATMPTPRBCYP3A4CTSSCTSK

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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 ATM 332/4885PTPRB 879/4885AAK1 588/4885

“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.