SCHEMBL9260431

SCHEMBL9260431

O=P(O)(O)Cc1ccccc1-c1ccccc1.[Na]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.56
ACP3 P15309 2/20 0.50
KMT2A Q03164 1/20 0.50
DPP4 P27487 1/20 0.48
FOLH1 Q04609 1/20 0.44
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP12 P39900 1/20 0.41
KCNA5 P22460 1/20 0.40
PTGER1 P34995 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40

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
SCHEMBL915620 0.98 MAPK1 (0.57) MAPK1ACP3KMT2ADPP4FOLH1
SCHEMBL9260425 0.96 MAPK1 (0.56) MAPK1ACP3KMT2ADPP4FOLH1
SCHEMBL11406555 0.84 ACP3 (0.50) MAPK1ACP3KMT2ADPP4FOLH1
SCHEMBL9179278 0.81 KMT2A (0.47) MAPK1KMT2ADPP4FOLH1PDCD1
SCHEMBL27463949 0.79 KMT2A (0.49) MAPK1KMT2ADPP4FOLH1PDCD1
SCHEMBL8053801 0.79 ACP3 (0.65) ACP3KMT2AMMP2MMP9MMP12
SCHEMBL29707862 0.79 ACP3 (0.65) ACP3KMT2AMMP2MMP9MMP12
Phosphoric Acid SCHEMBL28234427 0.78 KMT2A (0.52) MAPK1KMT2ADPP4FOLH1PDCD1
SCHEMBL916335 0.78 KMT2A (0.44) MAPK1KMT2ADPP4FOLH1PDCD1
Phosphoric Acid SCHEMBL28852127 0.77 PDCD1 (0.52) ACP3KMT2ADPP4FOLH1PDCD1

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
EP-0661978-A1 ARYLMETHYLPHOSPHONATES AND PHOSPHONIC ACIDS USEFUL AS ANTI-INFLAMMATORY AGENTS PHARMACIA & UPJOHN COMPANY (US) 1995-07-12 EP claimed
WO-1994007501-A1 ARYLMETHYLPHOSPHONATES AND PHOSPHONIC ACIDS USEFUL AS ANTI-INFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1994-04-14 WO claimed