Phosphoric Acid

Phosphoric Acid

SCHEMBL3757724

CS(=O)(=O)c1nn(C2CC2)c2nc(Nc3ccc(N4CCOCC4)cc3)nc(N)c12.O=P(O)(O)O

nearest known ligand 0.44

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Phosphoric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 known ✓ P52333 7/20 0.44
JAK2 known ✓ O60674 6/20 0.44
PTK2 Q05397 5/20 0.44
CFTR P13569 4/20 0.43
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
CDK4 P11802 4/20 0.41
CCND1 P24385 3/20 0.41
CCNB2 O95067 2/20 0.41
CDK1 P06493 2/20 0.41
CCNB1 P14635 2/20 0.41
CCND2 P30279 2/20 0.41
CCND3 P30281 2/20 0.41
CCNB3 Q8WWL7 2/20 0.41
CCNE2 O96020 1/20 0.41
CCNA2 P20248 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
CCNA1 P78396 1/20 0.41

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
SCHEMBL3748201 0.96 JAK3 (0.47) JAK3JAK2PTK2CFTRTP53
SCHEMBL3749814 0.92 JAK3 (0.45) JAK3JAK2PTK2CFTRTP53
SCHEMBL3749379 0.87 JAK2 (0.49) JAK3JAK2PTK2CDK4CCND1
SCHEMBL3754995 0.79 MAPK1 (0.47) JAK3JAK2PTK2CFTRTP53
SCHEMBL3751156 0.78 MAPT (0.46) JAK3JAK2PTK2CFTRTP53
SCHEMBL3750895 0.72 CDK4 (0.51) TP53MAPTMAPK1CDK4CCND1
SCHEMBL3757216 0.69 CDK4 (0.48) TP53MAPTMAPK1CDK4CCND1
SCHEMBL13048127 0.66 ADORA3 (0.57) JAK3JAK2TP53MAPTMAPK1
SCHEMBL12085363 0.65 CDK4 (0.65) TP53MAPTMAPK1CDK4CCND1
SCHEMBL13048167 0.65 TP53 (0.48) JAK3JAK2PTK2TP53MAPT

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-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2010-11-25 US disclosed
EP-2123654-A1 PYRAZOLOPYRIMIDINE COMPOUND Taisho Pharmaceutical Co. Ltd. (JP) 2009-11-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100298557-A1 PYRAZOLOPYRIMIDINE COMPOUND SYK, LCK, FYN JAK3 58/4885JAK2 13/4885PTK2 27/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.