SCHEMBL16200430

SCHEMBL16200430

Cc1ccc(-c2ccc(Cl)cc2C(C)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ FFAR1 O14842 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ PSEN1 P49768 2/20 0.36
▸ PSEN2 P49810 2/20 0.36

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
SCHEMBL17545763 0.84 KMT2A (0.44) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL12574599 0.80 ALDH1A1 (0.36) ALDH1A1HPGDFFAR1KCNH2PSEN1
SCHEMBL17540354 0.77 CTRC (0.45) KCNH2AKR1C2
SCHEMBL11331364 0.74 MEN1 (0.43) MEN1KMT2AALDH1A1TDP1NPC1
SCHEMBL1045006 0.74 AHR (0.57) —
SCHEMBL13494486 0.74 NOTUM (0.44) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL4058252 0.73 SLC6A4 (0.45) HPGDNPC1RAB9AHTR2ASLC6A4
SCHEMBL27395925 0.72 NOTUM (0.43) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL28533539 0.71 DHODH (0.50) MEN1KMT2AALDH1A1HPGDFFAR1
SCHEMBL16618296 0.71 TP53 (0.47) MEN1KMT2AALDH1A1HPGDTDP1

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-2507341-B1 COMPONENTS FOR HIGH FREQUENCY TECHNOLOGY, LIQUID CRYSTAL MEDIA AND COMPOUNDS MERCK PATENT GMBH (DE) 2014-10-29 — — EP disclosed
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