SCHEMBL19244142

SCHEMBL19244142

C[N+](C)(C)CCOP(=O)([O-])Oc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPK1 P28482 2/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
ESR1 P03372 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CDC25A P30304 1/20 0.42
AGTR1 P30556 1/20 0.42
AKT1 P31749 1/20 0.42
ADRA1A P35348 1/20 0.42
KCNH2 Q12809 1/20 0.42
TP53 P04637 1/20 0.42
PLA2G4B P0C869 2/20 0.41
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
BCHE P06276 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
SCHEMBL19749284 0.86 SMN1; SMN2 (0.44) SMN1; SMN2LMNAESR1ADORA3CDC25A
SCHEMBL19244141 0.86 MAPT (0.51) SMN1; SMN2LMNAESR1ADORA3CDC25A
SCHEMBL19265821 0.84 PKM (0.44) PKMMAPK1TSHRTP53PLA2G4B
SCHEMBL8154893 0.84 LMNA (0.47) PKMSMN1; SMN2LMNAESR1ADORA3
SCHEMBL19244145 0.82 LMNA (0.46) SMN1; SMN2MAPK1TSHRLMNAESR1
SCHEMBL19265822 0.82 CA1 (0.42) PKMMAPK1TSHRTP53PLA2G4B
SCHEMBL2825992 0.81 LMNA (0.45) SMN1; SMN2MAPK1TSHRLMNAESR1
SCHEMBL19749283 0.79 BCHE (0.38) SMN1; SMN2MAPK1TSHRLMNAESR1
SCHEMBL19697409 0.78 AKT1 (0.53) SMN1; SMN2LMNAESR1ADORA3CDC25A
SCHEMBL19749285 0.78 CA2 (0.53) SMN1; SMN2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3208275-B1 PHOSPHORYLCHOLINE GROUP-CONTAINING COMPOUND AND PHOSPHORYLCHOLINE COMPLEX NOF CORP (JP) 2019-01-09 EP disclosed
US-9850266-B2 Phosphorylcholine group-containing compound and phosphorylcholine complex NOF CORPORATION (JP) 2017-12-26 US disclosed
US-9850266-B2 Phosphorylcholine group-containing compound and phosphorylcholine complex NOF CORPORATION (JP) 2017-12-26 US disclosed
US-20170240576-A1 Phosphorylcholine Group-Containing Compound and Phosphorylcholine Complex NOF CORPORATION (JP) 2017-08-24 US disclosed
EP-3208275-A1 PHOSPHORYLCHOLINE GROUP-CONTAINING COMPOUND AND PHOSPHORYLCHOLINE COMPLEX NOF Corporation (JP) 2017-08-23 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-20170240576-A1 Phosphorylcholine Group-Containing Compound and Phosphorylcholine Complex PHOSPHO1, PCTP, PLA2G2C PKM 1011/4885SMN1; SMN2 2774/4885MAPK1 1078/4885

“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.