SCHEMBL10882371

SCHEMBL10882371

O=P(O)(O)C(O)(Cc1c(Cl)cccc1Cl)P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ FDPS P14324 11/20 0.54
▸ GGPS1 O95749 5/20 0.46
▸ BTN3A1 O00481 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ AKR1B1 P15121 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
SCHEMBL10882216 0.73 FDPS (0.63) FDPSGGPS1BTN3A1PDE3A
SCHEMBL10947618 0.72 PTGS2 (0.56) FDPS
SCHEMBL11307755 0.71 SMN1; SMN2 (1.00) SMN1; SMN2AKR1B1
SCHEMBL25064195 0.71 AKR1B1 (0.43) SMN1; SMN2AKR1B1
SCHEMBL10881272 0.71 FDPS (0.69) FDPSGGPS1BTN3A1PDE3A
SCHEMBL3846830 0.69 FDPS (1.00) FDPSGGPS1BTN3A1PDE3A
SCHEMBL11567106 0.68 TAAR1 (0.46) SMN1; SMN2AKR1B1
Phosphoric Acid SCHEMBL28200096 0.66 SMN1; SMN2 (0.50) SMN1; SMN2
SCHEMBL6980883 0.66 TAAR1 (0.44) SMN1; SMN2AKR1B1
SCHEMBL10881567 0.66 FDPS (0.60) FDPSGGPS1BTN3A1PDE3A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085321-B1 DIPHOSPHONIC ACID DERIVATIVES AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1986-08-27 — — EP claimed
US-4473560-A Diphosphonic acid derivatives and pharmaceutical preparations containing them SCHERING AKTIENGESELLSCHAFT (DE) 1984-09-25 — — US claimed
EP-0085321-A2 Diphosphonic acid derivatives and pharmaceutical preparations containing them SCHERING AKTIENGESELLSCHAFT (DE) 1983-08-10 — — EP claimed
EP-0085321-B1 DIPHOSPHONIC ACID DERIVATIVES AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1986-08-27 — — EP disclosed
US-4473560-A Diphosphonic acid derivatives and pharmaceutical preparations containing them SCHERING AKTIENGESELLSCHAFT (DE) 1984-09-25 — — US disclosed
EP-0085321-A2 Diphosphonic acid derivatives and pharmaceutical preparations containing them SCHERING AKTIENGESELLSCHAFT (DE) 1983-08-10 — — EP disclosed
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