SCHEMBL18587537

SCHEMBL18587537

CC1CCC(CNc2nc(Cl)nc3c2ncn3C2CCCO2)O1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 1/20 0.62
▸ ADORA3 P0DMS8 4/20 0.43
▸ ADORA1 P30542 4/20 0.43
▸ ADORA2A P29274 3/20 0.43
▸ ADORA2B P29275 2/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NT5E P21589 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ FLT3 P36888 1/20 0.41

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
SCHEMBL29664966 0.88 YTHDC1 (0.66) YTHDC1ADORA3ADORA1ADORA2ANPC1
SCHEMBL18587836 0.88 YTHDC1 (0.66) YTHDC1ADORA3ADORA1ADORA2ANPC1
SCHEMBL29665049 0.85 NPC1 (0.57) YTHDC1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL18587797 0.85 NPC1 (0.57) YTHDC1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL18588091 0.84 YTHDC1 (0.69) YTHDC1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL17902904 0.82 YTHDC1 (0.72) YTHDC1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL18587529 0.80 YTHDC1 (0.64) YTHDC1ADORA3ADORA1ADORA2ANPC1
SCHEMBL28429578 0.79 YTHDC1 (0.69) YTHDC1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL28433352 0.79 YTHDC1 (0.74) YTHDC1ADORA3ADORA1NPC1RAB9A
SCHEMBL29664987 0.78 YTHDC1 (0.61) YTHDC1ADORA3ADORA1ADORA2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3341371-B1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIV PALACKEHO (CZ) 2022-06-29 — — EP claimed
US-10774084-B2 Adenine derivatives and their use as UV-photoprotective agents UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2020-09-15 — — US claimed
US-20180298004-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2018-10-18 — — US claimed
EP-3341371-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS Univerzita Palackého V Olomouci (CZ) 2018-07-04 — — EP claimed
WO-2017036434-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2017-03-09 — — WO claimed
EP-3341371-B1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIV PALACKEHO (CZ) 2022-06-29 — — EP 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-20180298004-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS XPA, ERCC4, UNG YTHDC1 459/4885ADORA3 30/4885ADORA1 35/4885
US-10774084-B2 Adenine derivatives and their use as UV-photoprotective agents XPA, ERCC4, UNG YTHDC1 398/4885ADORA3 27/4885ADORA1 30/4885

“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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