SCHEMBL2463935

SCHEMBL2463935

C=C(C)CC(P(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 1/20 0.33
LMNA P02545 1/20 0.33
FDPS P14324 3/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9563436 0.75 LPAR1 (0.42) BTN3A1LMNAFDPSPGK1PGK2
SCHEMBL2455845 0.75 BTN3A1 (0.39) BTN3A1LMNAFDPS
Phosphoric Acid SCHEMBL5963671 0.74 BTN3A1 (0.33) BTN3A1LMNAFDPSPGK1PGK2
SCHEMBL28909650 0.69 HMGCR (0.37) BTN3A1LMNAPGK1PGK2
SCHEMBL28909659 0.69 HMGCR (0.37) BTN3A1LMNAHSD17B10TDP1
Phosphoric Acid SCHEMBL3215377 0.65 LAP3 (0.39) BTN3A1FDPSPGK1PGK2HSD17B10
Phosphoric Acid SCHEMBL3211434 0.65 LAP3 (0.39) BTN3A1FDPSPGK1PGK2HSD17B10
Phosphoric Acid SCHEMBL5963652 0.65 LAP3 (0.39) BTN3A1FDPSPGK1PGK2HSD17B10
Phosphoric Acid SCHEMBL3232688 0.65 LAP3 (0.39) BTN3A1FDPSPGK1PGK2HSD17B10
Phosphoric Acid SCHEMBL3221337 0.65 LAP3 (0.39) BTN3A1FDPSPGK1PGK2HSD17B10

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
US-8017596-B2 Phosphonates useful as modulators of T-γ-9-δ-2 activity INNATE PHARMA, S.A. (FR) 2011-09-13 US disclosed
US-20100204184-A1 Phosphonates useful as modulators of T-gamma-9-delta-2 activity LABORATOIRES MAYOLY SPINDLER (FR) 2010-08-12 US disclosed
US-20060241087-A1 Phosphonates useful as modulators of t $g(g)9$g(d)2 lymphocyte activity MONTERO JEAN-LOUIS 2006-10-26 US disclosed
EP-1453840-A1 PHOSPHONATES USEFUL AS MODULATORS OF T-GAMMA-9-DELTA-2 LYMPHOCYTE ACTIVITY Laboratoire Mayoly Spindler (FR) 2004-09-08 EP disclosed
WO-2003050128-A1 PHOSPHONATES USEFUL AS MODULATORS OF T $G(G)9$G(D)2 LYMPHOCYTE ACTIVITY LABORATOIRE MAYOLY SPINDLER (FR) 2003-06-19 WO 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 (2 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-20100204184-A1 Phosphonates useful as modulators of T-gamma-9-delta-2 activity CD4, PRKCD, PRKCZ BTN3A1 417/4885LMNA 2695/4885FDPS 2881/4885
US-20060241087-A1 Phosphonates useful as modulators of t $g(g)9$g(d)2 lymphocyte activity CD4, GNG2, PLCG2 BTN3A1 797/4885LMNA 3304/4885FDPS 2441/4885

“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.