SCHEMBL7909102

SCHEMBL7909102

Cc1ccc(N(c2ccc(C(=O)O)cc2)c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C(=O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
SRD5A2 P31213 2/20 0.59
RXRA P19793 3/20 0.58
RXRB P28702 3/20 0.58
PTGES O14684 1/20 0.51
ALOX5 P09917 1/20 0.51
MAP4K4 O95819 1/20 0.49
BCL2L1 Q07817 1/20 0.48
BAD Q92934 1/20 0.48
RARB P10826 2/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.45
CES2 O00748 1/20 0.45

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
SCHEMBL8973613 0.94 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2SRD5A2RXRARXRB
SCHEMBL3741672 0.94 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2SRD5A2RXRARXRB
SCHEMBL15569594 0.90 BCL2L1 (0.58) SRD5A2RXRARXRBBCL2L1BAD
SCHEMBL13888048 0.88 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2SRD5A2RXRARXRB
SCHEMBL308875 0.88 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2SRD5A2RXRARXRB
SCHEMBL15725684 0.85 MAPT (0.53) ALDH1A1SMN1; SMN2ALOX5KDM4EGAA
SCHEMBL18390948 0.85 MAPT (0.53) ALDH1A1SMN1; SMN2ALOX5KDM4EGAA
SCHEMBL21760526 0.84 EGFR (0.53) ALDH1A1SRD5A2RXRARXRBPTGES
SCHEMBL14769783 0.84 EGFR (0.53) ALDH1A1SRD5A2RXRARXRBPTGES
SCHEMBL17040204 0.83 TSHR (0.67) ALDH1A1SMN1; SMN2SRD5A2BCL2L1BAD

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-6284365-B1 FOR CONTROLLING PHYSICAL PROPERTIES OF SURFACE AND INTERFACE OF SOLID ARTICLE SUCH AS WETTABILITY, ADHESIVE PROPERTY, SURFACE ENERGY, DISPERSABILITY, CHEMICAL RESISTANCE FUJI XEROX CO., LTD. (JP) 2001-09-04 US disclosed