SCHEMBL7146147

SCHEMBL7146147

CC1(C)O[C@@H]2[C@H](O1)[C@@H](n1nc(C#N)c(C#N)c1N)O[C@H]2CO

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.43
▸ PI4K2B Q8TCG2 1/20 0.43
▸ PI4K2A Q9BTU6 1/20 0.43
▸ PI4KB Q9UBF8 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CDK5 Q00535 1/20 0.35
▸ CDK5R1 Q15078 1/20 0.35
▸ HSPA8 P11142 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ P2RX1 P51575 1/20 0.30
▸ P2RX3 P56373 1/20 0.30
▸ P2RX4 Q99571 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
SCHEMBL7151907 0.78 CDK5 (0.51) ALDH1A1LMNATDP1CDK5CDK5R1
SCHEMBL27538638 0.78 CDK5 (0.51) ALDH1A1LMNATDP1CDK5CDK5R1
SCHEMBL7151910 0.78 CDK5 (0.51) ALDH1A1LMNATDP1CDK5CDK5R1
SCHEMBL20142031 0.78 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBCDK5
SCHEMBL10399408 0.77 PI4KA (0.59) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL10401684 0.77 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL22333913 0.77 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL22334084 0.77 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL7149845 0.77 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL27363697 0.72 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6642206-B2 Useful in treating a wide variety of diseases including infections, infestations, neoplasms and autoimmune diseases ICN PHARMACEUTICALS, INC. 2003-11-04 — — US disclosed
US-6573248-B2 Therapeutic agent for use in the treatment of tumors, infections, infestation and autoimmune disease ICN PHARMACEUTICALS, INC. 2003-06-03 — — US disclosed
US-6552183-B1 Moncyclic L-nucleosides analogs ICN PHARMACEUTICALS, INC. 2003-04-22 — — US disclosed
EP-1302474-A1 Monocyclic L-nucleosides, analogs and uses thereof Ribapharm, Inc. (US) 2003-04-16 — — EP disclosed
US-20030018186-A1 Monocyclic L-nucleosides, analogs and uses thereof BAUSCH HEALTH COMPANIES INC. (CA) 2003-01-23 — — US disclosed
EP-1254911-A1 Monocyclic L-nucleosides, analogs and uses thereof ICN Pharmaceuticals, Inc. (US) 2002-11-06 — — EP disclosed
US-20020095033-A1 Monocyclic L-nucleosides, analogs and uses thereof ICN PHARMACEUTICALS, INC. 2002-07-18 — — US disclosed
US-6130326-A Monocyclic L-Nucleosides, analogs and uses thereof ICN PHARMACEUTICALS, INC. (US) 2000-10-10 — — 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 (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-20030018186-A1 Monocyclic L-nucleosides, analogs and uses thereof PNP, TYMP, SLC29A1 PI4KA 2266/4885PI4K2B 2425/4885PI4K2A 2550/4885
US-20020095033-A1 Monocyclic L-nucleosides, analogs and uses thereof PNP, TYMP, SLC29A1 PI4KA 2266/4885PI4K2B 2425/4885PI4K2A 2550/4885

“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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