SCHEMBL29664972

SCHEMBL29664972

Clc1nc(Nc2cccs2)c2ncn(C3CCCO3)c2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 1/20 0.61
▸ FLT3 P36888 4/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ PI4KA P42356 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ADCY1 Q08828 1/20 0.42
▸ PI4K2B Q8TCG2 1/20 0.42
▸ PI4K2A Q9BTU6 1/20 0.42
▸ PI4KB Q9UBF8 1/20 0.42

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
SCHEMBL18587078 1.00 YTHDC1 (0.61) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL18587965 0.84 YTHDC1 (0.59) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL29664961 0.84 YTHDC1 (0.59) YTHDC1NPC1RAB9ASMN1; SMN2ADORA3
SCHEMBL18587515 0.83 YTHDC1 (0.57) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL21967830 0.82 YTHDC1 (0.65) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL29664969 0.82 YTHDC1 (0.59) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL20533712 0.82 YTHDC1 (0.59) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL21967819 0.81 YTHDC1 (0.66) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL21967608 0.81 YTHDC1 (0.62) YTHDC1FLT3NPC1RAB9ASMN1; SMN2
SCHEMBL21967835 0.81 YTHDC1 (0.62) YTHDC1FLT3NPC1RAB9ASMN1; SMN2

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
EP-3341371-B1 ADENINE DERIVATIVES AND THEIR USE AS UV-PHOTOPROTECTIVE AGENTS UNIV PALACKEHO (CZ) 2022-06-29 — — EP claimed
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