SCHEMBL22201821

SCHEMBL22201821

CCOC(=O)/C(C#N)=C/c1cn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2nccc(C(F)(F)F)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 1/20 0.41
▸ ATM Q13315 2/20 0.40
▸ ALDH1A1 P00352 9/20 0.39
▸ MAPT P10636 8/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ STAT1 P42224 1/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ THRB P10828 2/20 0.39
▸ HPGD P15428 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ APP P05067 1/20 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
SCHEMBL29394975 0.92 PTP4A1 (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL22201852 0.92 MIF (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL30426404 0.92 MIF (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL20615238 0.92 PTP4A1 (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL22201853 0.91 MIF (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL29396028 0.91 ALDH1A1 (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL20615240 0.91 ALDH1A1 (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL22201851 0.91 MIF (0.41) MIFATMALDH1A1MAPTNPC1
SCHEMBL22201820 0.90 ALDH1A1 (0.40) MIFATMALDH1A1MAPTNPC1
SCHEMBL22201870 0.90 MIF (0.40) MIFATMALDH1A1MAPTNPC1

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-2020142413-A1 COMPOSITIONS AND METHODS FOR MODULATING HAIR GROWTH THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-09 — — WO disclosed
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