SCHEMBL8388178

SCHEMBL8388178

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nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
ALOX15 P16050 4/20 0.35
MEN1 O00255 2/20 0.33
CYP3A4 P08684 2/20 0.33
BTN3A1 O00481 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
NOS1 P29475 1/20 0.32
TSHR P16473 1/20 0.32
UGT1A1 P22309 1/20 0.32
SQLE Q14534 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31

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
SCHEMBL5677066 0.83
SCHEMBL15129750 0.81
SCHEMBL9633370 0.77
SCHEMBL2555631 0.74 KMT2A (0.68) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL437402 0.72
SCHEMBL1304714 0.72
SCHEMBL8051946 0.72
SCHEMBL6240034 0.72 FNTA (0.41) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL1305484 0.72 KMT2A (0.33) KMT2AALOX15MEN1CYP3A4
SCHEMBL1360592 0.72

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-0565488-B1 Fluorine free titanocenes and their application CIBA GEIGY AG (CH) 1999-04-21 EP disclosed
US-5340701-A Photoinitiators CIBA-GEIGY CORPORATION (US) 1994-08-23 US disclosed
EP-0565488-A1 Fluorine free titanocenes and their application CIBA-GEIGY AG (CH) 1993-10-13 EP disclosed