SCHEMBL20104998

SCHEMBL20104998

CCCCNc1nc(Cl)nc2c1ncn2C1CCCCO1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 1/20 0.72
▸ CTSL P07711 1/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ ADORA3 P0DMS8 4/20 0.46
▸ ADORA1 P30542 3/20 0.46
▸ FLT3 P36888 2/20 0.46
▸ CYP2C19 P33261 1/20 0.45
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ HPGD P15428 1/20 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
SCHEMBL28433352 0.94 YTHDC1 (0.74) YTHDC1CTSLNPC1RAB9ASMN1; SMN2
SCHEMBL16549246 0.90 YTHDC1 (0.69) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL16549233 0.89 YTHDC1 (0.68) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL17902915 0.88 YTHDC1 (0.71) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL17929775 0.87 YTHDC1 (0.70) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL6820593 0.85 CTSL (0.66) YTHDC1CTSLADORA3ADORA1FLT3
SCHEMBL28426649 0.85 YTHDC1 (0.67) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL17902904 0.84 YTHDC1 (0.72) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL19049986 0.84 YTHDC1 (1.00) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL5695023 0.83 YTHDC1 (0.65) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3

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
US-20180117048-A1 6-AMINO-PURIN-8-ONE COMPOUNDS GLAXOSMITHKLINE LLC 2018-05-03 — — 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-20180117048-A1 6-AMINO-PURIN-8-ONE COMPOUNDS IFNG, IFNAR1, IRF3 YTHDC1 1280/4885CTSL 518/4885NPC1 3032/4885

“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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