SCHEMBL10812971

SCHEMBL10812971

CSCOCc1cnc(SC)nc1C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MEN1 O00255 5/20 0.32
▸ KMT2A Q03164 5/20 0.32
▸ HTT P42858 1/20 0.31
▸ ALDH1A1 P00352 4/20 0.31
▸ POLB P06746 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL10817585 0.84 AHR (0.35) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL10970412 0.78 AHR (0.34) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL13573561 0.75 AHR (0.40) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL16978978 0.75 RAB9A (0.41) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL28988146 0.74 MEN1 (0.38) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL10816664 0.74 KDM4E (0.43) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL10812261 0.70 MEN1 (0.34) AHRMEN1KMT2AALDH1A1TDP1
SCHEMBL20528659 0.70 AHR (0.37) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL17970848 0.69 RAB9A (0.44) AHRNPC1RAB9AMEN1KMT2A
SCHEMBL12639170 0.68 MEN1 (0.45) MEN1KMT2AALDH1A1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0087326-B1 SUBSTITUTED PYRIMIDIN-2-ONES AND THE SALTS THEREOF NYCOMED AS (NO) 1987-05-13 — — EP disclosed
US-4539324-A ANTICANCER AGENTS NYEGAARD & CO. A/S (NO) 1985-09-03 — — US disclosed
EP-0087326-A1 Substituted pyrimidin-2-ones and the salts thereof NYCOMED AS (NO) 1983-08-31 — — EP disclosed
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