SCHEMBL23643401

SCHEMBL23643401

COc1cc(Nc2nc(S)nc(S)n2)cc(OC)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43
▸ TUBB4B P68371 1/20 0.43
▸ TUBB3 Q13509 1/20 0.43
▸ TUBB2A Q13885 1/20 0.43
▸ TUBB8 Q3ZCM7 1/20 0.43
▸ TUBA3E Q6PEY2 1/20 0.43
▸ TUBA1A Q71U36 1/20 0.43
▸ TUBA1C Q9BQE3 1/20 0.43
▸ TUBB6 Q9BUF5 1/20 0.43
▸ TUBB2B Q9BVA1 1/20 0.43
▸ TUBB1 Q9H4B7 1/20 0.43
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ BRAF P15056 1/20 0.38
▸ PTK2 Q05397 3/20 0.37

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
SCHEMBL23643398 0.77 GAA (0.47) MAPTGAANPC1RAB9ACA1
SCHEMBL23643400 0.74 TTR (0.38) MAPTGAANPC1RAB9AAURKA
SCHEMBL11613891 0.73 ALDH1A1 (0.45) MAPTGAACA1CA2LMNA
SCHEMBL13955883 0.71 IGF1R (0.59) BRAFPTK2AURKAKDRAURKB
SCHEMBL8629439 0.70 MAPT (0.64) MAPTGAANPC1RAB9APKM
SCHEMBL8734640 0.68 PKM (0.48) TUBB1MAPTGAACA12CA1
SCHEMBL23643492 0.67 MAPT (0.42) MAPTKDRIGF1RKMT2AMEN1
SCHEMBL6577706 0.66 PKM (0.47) TUBB1MAPTGAACA12CA1
SCHEMBL3269159 0.66 ABCG2 (0.67) ABCG2MAPTGAANPC1RAB9A
SCHEMBL17394819 0.66 POLB (0.56) MAPTGAAPTK2NPC1RAB9A

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
WO-2021141984-A1 SUBSTITUTED TRIAZINE COMPOUNDS AND USES THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2021-07-15 — — WO disclosed
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