SCHEMBL13467415

SCHEMBL13467415

CCC(Nc1ncnc2c1ncn2[C@H]1CC[C@@H](CO)O1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NR2F2 P24468 3/20 0.49
▸ ABL1 P00519 2/20 0.49
▸ RIN1 Q13671 2/20 0.49
▸ GALR3 O60755 1/20 0.48

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
SCHEMBL12579635 0.85 ABL1 (0.49) NR2F2ABL1RIN1GALR3
SCHEMBL12579947 0.84 HIF1A (0.57) —
SCHEMBL14713449 0.82 NPC1 (0.61) —
SCHEMBL14713447 0.82 NPC1 (0.61) —
SCHEMBL12579979 0.81 ALDH1A1 (0.48) NR2F2
Phenol SCHEMBL27699602 0.81 ABL1 (0.52) NR2F2ABL1RIN1GALR3
SCHEMBL13467459 0.80 ABL1 (0.56) NR2F2ABL1RIN1
SCHEMBL2036287 0.80 ALDH1A1 (0.55) NR2F2ABL1RIN1
SCHEMBL29318369 0.80 YTHDC1 (0.59) ABL1RIN1
SCHEMBL2041441 0.80 YTHDC1 (0.59) ABL1RIN1

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
EP-2511283-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES, N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2012-10-17 — — EP disclosed
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