SCHEMBL20533808

SCHEMBL20533808

CC(Nc1nc(Cl)nc2c1ncn2C1CCCO1)C1CCCO1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 1/20 0.67
▸ ADORA3 P0DMS8 10/20 0.49
▸ ADORA1 P30542 9/20 0.49
▸ ADORA2A P29274 5/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ PI4KA P42356 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ADCY1 Q08828 1/20 0.43
▸ PI4K2B Q8TCG2 1/20 0.43
▸ PI4K2A Q9BTU6 1/20 0.43
▸ PI4KB Q9UBF8 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
SCHEMBL29664968 1.00 YTHDC1 (0.67) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL19010862 0.88 YTHDC1 (0.73) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL17902901 0.87 YTHDC1 (0.79) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL20533736 0.84 TP53 (0.57) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL29664967 0.84 TP53 (0.57) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL4649311 0.82 YTHDC1 (0.72) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL20533803 0.81 YTHDC1 (0.61) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL29665008 0.81 YTHDC1 (0.61) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL7265803 0.81 YTHDC1 (0.73) YTHDC1ADORA3ADORA1ADORA2ACYP2C19
SCHEMBL19049986 0.80 YTHDC1 (1.00) YTHDC1ADORA3ADORA1ADORA2ACYP2C19

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-B1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIV PALACKEHO (CZ) 2022-06-29 — — EP disclosed
US-10774084-B2 Adenine derivatives and their use as UV-photoprotective agents UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2020-09-15 — — US disclosed
US-20180298004-A1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2018-10-18 — — 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 (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.

Send feedback