SCHEMBL22875603

SCHEMBL22875603

CCCCCCCCCCCCC(=O)O[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1COP(=O)(OCCCCCCCCCC)OCCCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 4/20 0.55
▸ P2RY2 P41231 3/20 0.55
▸ SRC P12931 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ DNPH1 O43598 1/20 0.55
▸ PRKAB2 O43741 1/20 0.55
▸ TRPM2 O94759 1/20 0.55
▸ LDHA P00338 1/20 0.55
▸ ADRB2 P07550 1/20 0.55
▸ FBP1 P09467 1/20 0.55
▸ ADORA1 P30542 1/20 0.55
▸ PRKAG1 P54619 1/20 0.55
▸ PRKAA2 P54646 1/20 0.55
▸ PDE4D Q08499 1/20 0.55
▸ KCNH2 Q12809 1/20 0.55
▸ PRKAA1 Q13131 1/20 0.55
▸ PDE3A Q14432 1/20 0.55
▸ TAS1R3 Q7RTX0 1/20 0.55
▸ TAS1R1 Q7RTX1 1/20 0.55
▸ P2RY11 Q96G91 1/20 0.55

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
SCHEMBL22875448 0.89 P2RX3 (0.49) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL22875576 0.88 EHMT1 (0.60) EHMT1AHCY
SCHEMBL22875787 0.88 EHMT1 (0.60) EHMT1AHCY
SCHEMBL22875605 0.88 P2RY1 (0.70) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL18340532 0.84 DNPH1 (0.68) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL22875579 0.83 POLB (0.49) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL18340531 0.82 ADORA1 (0.62) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL10587742 0.81 AHCY (0.61) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL11909560 0.81 P2RY1 (0.71) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL11909558 0.81 P2RY1 (0.71) P2RY1P2RY2SRCSMN1; SMN2DNPH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210007999-A1 NANOPARTICLE COMPOSITIONS JANUARY THERAPEUTICS, INC. 2021-01-14 — — US 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-20210007999-A1 NANOPARTICLE COMPOSITIONS PNP, NTPCR, TYMP P2RY1 446/4885P2RY2 1044/4885SRC 1041/4885

“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.

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