SCHEMBL9099105

SCHEMBL9099105

O=P(c1ccccc1)(c1ccccc1)c1ccc2c(c1)oc1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.49
KMT2A Q03164 8/20 0.47
MEN1 O00255 7/20 0.47
KDM4E B2RXH2 5/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 4/20 0.47
NPSR1 Q6W5P4 1/20 0.44
TTR P02766 1/20 0.44
MAOA P21397 2/20 0.44
SMN1; SMN2 Q16637 5/20 0.43
HSD17B10 Q99714 3/20 0.43
LMNA P02545 2/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
GAA P10253 3/20 0.43
TP53 P04637 3/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
GLA P06280 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
SCHEMBL17614153 1.00 AHR (0.49) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL22302361 0.95 LMNA (0.42) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL21019564 0.92 AHR (0.41) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL24470239 0.90 MAPT (0.49) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL21123027 0.89 AHR (0.42) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL21122829 0.89 MAOA (0.38) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL30592720 0.89 AHR (0.45) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL20249846 0.85 MAOB (0.47) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL16440658 0.84 PLA2G2A (0.48) AHRKMT2AMEN1KDM4EMAPT
SCHEMBL21123212 0.84 MEN1 (0.44) AHRKMT2AMEN1KDM4EMAPT

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-5510503-A Bisphosphines for asymmetric hydrogenation catalysts BAYER AKTIENGESELLSCHAFT (DE) 1996-04-23 US disclosed