SCHEMBL23863370

SCHEMBL23863370

Cc1cc(NC(=O)C(=O)NO)cc(Cl)c1Oc1ccc(O)c(CN2CCCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.47
THRA P10827 9/20 0.47
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL18932863 0.93 TSHR (0.42) THRBTHRAGAA
SCHEMBL18998857 0.91 THRA (0.47) THRBTHRAGAAALDH1A1
SCHEMBL6656537 0.88 THRA (0.53) THRBTHRAGAA
SCHEMBL18932864 0.87 ABL1 (0.43) THRBTHRA
SCHEMBL18998874 0.86 THRA (0.41) THRBTHRAALDH1A1
SCHEMBL18932862 0.85 CTSB (0.42) THRBTHRAGAAALDH1A1
SCHEMBL18932874 0.84 RAB9A (0.44) THRBTHRAALDH1A1
SCHEMBL6657849 0.84 THRA (0.47) THRBTHRAGAA
SCHEMBL6659271 0.82 THRA (0.43) THRBTHRAGAAALDH1A1
SCHEMBL18932871 0.81 EPHX1 (0.39) THRBTHRA

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
EP-3181556-B1 MICROMOLECULE COMPOUND, METHOD OF SYNTHESIS AND APPLICATION THEREOF TECHNODERMA MEDICINES PTE LTD (CN) 2021-09-29 EP disclosed