SCHEMBL9319418

SCHEMBL9319418

CC(C)c1ccc(-c2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
LMNA P02545 2/20 0.60
RAB9A P51151 2/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
ACACB O00763 1/20 0.56
ACACA Q13085 1/20 0.56
ALDH1A1 P00352 3/20 0.54
PTGS2 P35354 3/20 0.53
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
SRD5A2 P31213 1/20 0.52
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
GABRA1 P14867 1/20 0.51
GABRB1 P18505 1/20 0.51

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
SCHEMBL50522 0.94 ALDH1A1 (0.61) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL28415302 0.92 CNR1 (0.57) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL1148332 0.85 CNR1 (0.58) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL9442717 0.85 MAPT (0.56) MAPTLMNARAB9AMEN1KMT2A
Bicarbonate SCHEMBL27623724 0.84 PTGS2 (0.67) MAPTLMNAMEN1KMT2APTGS2
SCHEMBL13019488 0.83 RAB9A (0.82) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL197633 0.83 RAB9A (0.82) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL9245335 0.82 RAB9A (0.53) MAPTLMNARAB9AMEN1KMT2A
SCHEMBL2627825 0.82 RXRA (0.68) MAPTALDH1A1RXRARXRBRXRG
Acetic Acid SCHEMBL9809790 0.82 PTGS2 (0.64) MAPTACACBACACAPTGS2RXRA

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
US-5073611-A Containing photoreactive compound capable of abstracting hydrogen; coatings, hot melt adhesives BASF AKTIENGESELLSCHAFT (DE) 1991-12-17 US claimed
EP-0395990-B1 Copolymers curable by ultraviolet radiation under air oxygen atmosphere BASF AG (DE) 1994-01-05 EP disclosed
US-5073611-A Containing photoreactive compound capable of abstracting hydrogen; coatings, hot melt adhesives BASF AKTIENGESELLSCHAFT (DE) 1991-12-17 US disclosed