SCHEMBL8117118

SCHEMBL8117118

O=C1CC(=O)OC(c2ccccc2Cl)(c2ccccc2Cl)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
GRIN1 Q05586 4/20 0.38
GRIN2A Q12879 4/20 0.38
SLC6A4 P31645 2/20 0.38
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
LMNA P02545 2/20 0.38
OPRK1 P41145 1/20 0.38
OPRM1 P35372 1/20 0.38
CACNA1C Q13936 1/20 0.38
HDAC4 P56524 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
AHR P35869 2/20 0.34
TP53 P04637 1/20 0.34
RECQL P46063 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
SCHEMBL8121004 0.77 HDAC4 (0.38) LMNAOPRM1HDAC4SIGMAR1TSHR
SCHEMBL8106375 0.77 AKR1C1 (0.35) SIGMAR1ALDH1A1
SCHEMBL8123326 0.74 CYP2D6 (0.45) LMNAHDAC4SIGMAR1TSHRALDH1A1
SCHEMBL8121148 0.73 KMT2A (0.43) SIGMAR1ALDH1A1
SCHEMBL8122274 0.71 CFTR (0.39) RECQLALDH1A1
SCHEMBL8115288 0.68 KMT2A (0.40) SLC6A4LMNAHDAC4AHRALDH1A1
SCHEMBL8107503 0.67 HCAR3 (0.42) SLC6A4
SCHEMBL8118617 0.67 TP53 (0.43) CRHBPCRHR2GRIN1GRIN2ASLC6A4
SCHEMBL17911548 0.66 SIGMAR1 (0.43) SIGMAR1AHRTP53ALDH1A1
SCHEMBL11134355 0.64 HDAC4 (0.37) LMNAOPRM1HDAC4SIGMAR1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed