SCHEMBL7948817

SCHEMBL7948817

CC(O)COc1nc(N2CCCCC2)c2ncnc(N3CCCCC3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 12/20 0.57
▸ PKM P14618 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ ATM Q13315 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PDE2A O00408 1/20 0.38
▸ RGS12 O14924 1/20 0.38
▸ SLC22A2 O15244 1/20 0.38
▸ SLC22A1 O15245 1/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ ABCC5 O15440 1/20 0.38

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
SCHEMBL7947717 0.81 SLC29A1 (0.86) SLC29A1PKMNPC1MAPTLMNA
SCHEMBL7971739 0.81 SLC29A1 (0.60) SLC29A1MAPTLMNAKDM4ETSHR
SCHEMBL7953158 0.80 SLC29A1 (0.74) SLC29A1PKMNPC1MAPTLMNA
SCHEMBL7949410 0.79 SLC29A1 (0.63) SLC29A1PKMNPC1MAPTLMNA
SCHEMBL1276832 0.75 SLC29A1 (0.61) SLC29A1MAPTLMNAKDM4ETSHR
SCHEMBL9565592 0.74 SLC29A1 (0.49) SLC29A1PKMNPC1MAPTLMNA
SCHEMBL7970119 0.73 SLC29A1 (0.66) SLC29A1MAPTLMNAKDM4ETSHR
SCHEMBL11471053 0.72 HTT (0.58) PKMNPC1MAPTLMNAKDM4E
SCHEMBL7976583 0.70 SLC29A1 (0.71) SLC29A1MAPTLMNAKDM4ETSHR
SCHEMBL7960351 0.70 SLC29A1 (0.61) SLC29A1MAPTLMNAKDM4ETSHR

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
JP-2001517226-A — — 2001-10-02 — — JP claimed
EP-0971925-A1 PYRIMIDOPYRIMIDINE COMPOUNDS NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 2000-01-19 — — EP claimed
WO-1998043974-A1 PYRIMIDOPYRIMIDINE COMPOUNDS NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 1998-10-08 — — WO claimed
US-20240166770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF CELL-PENETRATING ANTIBODIES YALE UNIVERSITY 2024-05-23 — — US disclosed
WO-2021077070-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF CELL-PENETRATING ANTIBODIES YALE UNIVERSITY (US) 2021-04-22 — — WO disclosed
US-6297250-B1 USEFUL FOR INHIBITING TRANSPORT OF NUCLEOSIDES OR PURINES ACROSS CELL MEMBRANES, THEREBY TO POTENTIATE THE ACTIVITY OF VARIOUS CYTOTOXIC ANTITUMOR DRUGS NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 2001-10-02 — — 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-20240166770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF CELL-PENETRATING ANTIBODIES SLC29A1, SLC29A2, SLC7A1 SLC29A1 1/4885PKM 1421/4885NPC1 690/4885

“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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