SCHEMBL10857063

SCHEMBL10857063

O=C(N[C@H](C(=O)Cl)c1ccccc1)OCC(Cl)(Cl)Cl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.44
CTSS P25774 2/20 0.43
CTSL P07711 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CTSK P43235 2/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PPARG P37231 1/20 0.37

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
SCHEMBL10857056 1.00 ATM (0.44) ATMCTSSCTSLMEN1KMT2A
SCHEMBL10493249 0.90 ATM (0.54) ATMCTSSCTSLMEN1KMT2A
SCHEMBL10640347 0.90 ATM (0.54) ATMCTSSCTSLMEN1KMT2A
SCHEMBL10970559 0.87 CTSS (0.45) ATMCTSSCTSLMEN1KMT2A
SCHEMBL10970564 0.87 ATM (0.46) ATMCTSSCTSLMEN1KMT2A
SCHEMBL11695044 0.78 KMT2A (0.42) ATMCTSSCTSLMEN1KMT2A
SCHEMBL11514968 0.78 KMT2A (0.42) ATMCTSSCTSLMEN1KMT2A
SCHEMBL11677509 0.78 CYP2C9 (0.51) ATMCTSSCTSLMEN1KMT2A
SCHEMBL8850173 0.77 MEN1 (0.46) ATMMEN1KMT2ACTSKHTT
SCHEMBL11162533 0.76 MEN1 (0.40) ATMCTSSCTSLMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4576753-A MICROBIOCIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-03-18 US disclosed
US-4472309-A ANTIMICROBIAL FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
US-4304718-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-12-08 US disclosed
US-4181800-A ANTIBIOTICS FROM SUBSTITUTED PERHYDRO-S-TRIAZINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-01 US disclosed