SCHEMBL20191893

SCHEMBL20191893

C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@@H]1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 4/20 0.55
▸ PI4K2B Q8TCG2 4/20 0.55
▸ PI4K2A Q9BTU6 4/20 0.55
▸ PI4KB Q9UBF8 4/20 0.55
▸ TP53 P04637 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ APEX1 P27695 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ ADCY1 Q08828 1/20 0.55
▸ AHCY P23526 6/20 0.54
▸ ADORA2A P29274 4/20 0.54
▸ ADA P00813 1/20 0.53
▸ STING1 Q86WV6 1/20 0.53
▸ ADORA3 P0DMS8 2/20 0.51

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
SCHEMBL13986298 0.88 AHCY (0.57) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL13986311 0.88 AHCY (0.57) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL10015774 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL284737 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL5962596 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL23396436 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL5962598 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL896624 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL20794222 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53
SCHEMBL29362124 0.86 AHCY (0.59) PI4KAPI4K2BPI4K2API4KBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9982237-B2 Compositions and methods for reprograming non-pluripotent cells into pluripotent stem cells HONG GUAN, LTD. (CN) 2018-05-29 — — US disclosed
US-9982237-B2 Compositions and methods for reprograming non-pluripotent cells into pluripotent stem cells HONG GUAN, LTD. (CN) 2018-05-29 — — US disclosed
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