SCHEMBL9548659

SCHEMBL9548659

CC(C)(C)[Si](C)(C)O[C@H]1C[C@H](n2cnc3c(N)ncnc32)OC1(CO)CO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADA P00813 1/20 0.47
PI4K2A Q9BTU6 3/20 0.46
PI4KA P42356 2/20 0.46
PI4K2B Q8TCG2 2/20 0.46
PI4KB Q9UBF8 2/20 0.46
TP53 P04637 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
APEX1 P27695 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
ADCY1 Q08828 1/20 0.46
SLC28A1 O00337 1/20 0.45
SLC28A2 O43868 1/20 0.45
ADORA2A P29274 5/20 0.43
ADORA3 P0DMS8 3/20 0.43

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
SCHEMBL9548674 1.00 ADA (0.47) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL30618130 1.00 ADA (0.47) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548635 0.94 ADA (0.44) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548630 0.94 ADA (0.44) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548784 0.90 ADA (0.47) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548793 0.90 ADA (0.47) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548668 0.90 NFKB1 (0.41) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548677 0.90 NFKB1 (0.41) ADAPI4K2API4KAPI4K2BPI4KB
SCHEMBL9548650 0.88 AHCY (0.44) TP53ADORA2AADORA3AHCYADORA2B
SCHEMBL9548908 0.88 AHCY (0.44) TP53ADORA2AADORA3AHCYADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12187758-B2 Compounds and methods for treating disease ROME THERAPEUTICS, INC. (US) 2025-01-07 US disclosed
US-20230374058-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20230295212-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE ROME THERAPEUTICS INC (US) 2023-09-21 US disclosed
US-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 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 (3 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-20230295212-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE EHMT1, POLRMT, RNASE1 ADA 1726/4885PI4K2A 1029/4885PI4KA 829/4885
US-20230374058-A1 COMPOUNDS AND METHODS FOR TREATING DISEASE EHMT1, POLRMT, RNASE1 ADA 1726/4885PI4K2A 1029/4885PI4KA 829/4885
US-12187758-B2 Compounds and methods for treating disease EHMT1, POLRMT, RNASE1 ADA 1726/4885PI4K2A 1029/4885PI4KA 829/4885

“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.