SCHEMBL8773537

SCHEMBL8773537

C#COc1ccccc1OCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.52
PTPRC P08575 1/20 0.52
PTPN2 P17706 1/20 0.52
PTPRB P23467 1/20 0.52
PTPN6 P29350 1/20 0.52
PTPN11 Q06124 1/20 0.52
MAOB P27338 5/20 0.47
RXRA P19793 3/20 0.46
RXRB P28702 3/20 0.46
RXRG P48443 3/20 0.46
IDO1 P14902 2/20 0.45
SLC6A4 P31645 2/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
PPIA P62937 1/20 0.42
LIPE Q05469 1/20 0.42

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
SCHEMBL8773563 0.85 RXRA (0.46) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL8773573 0.80 HTR1A (0.48) MAOBRXRARXRBRXRGLIPE
SCHEMBL30889094 0.80 APP (0.63) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL8773534 0.78 MAOB (0.64) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL2865421 0.76 RXRA (0.56) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL23474598 0.74 GAA (0.58) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL5511945 0.74 PTPRC (0.54) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL3457914 0.74 PTPRC (0.54) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL5507599 0.74 PTPN1 (0.57) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL2873573 0.72 MAOB (0.69) PTPN1PTPRCPTPN2PTPRBPTPN6

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-0577555-B1 Derivatives of carboxylic acids CIBA GEIGY AG (CH) 1997-11-05 EP claimed