SCHEMBL9150935

SCHEMBL9150935

CCCc1cc(N(O)O)ccc1C(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
TSHR P16473 3/20 0.45
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HSP90AA1 P07900 2/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL7152954 0.89 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL2007047 0.81 PTPN1 (0.39) KMT2AMEN1ALDH1A1KDM4EL3MBTL1
SCHEMBL1193719 0.80 CA12 (0.66) CA12CA1CA2CA7CA9
SCHEMBL8191128 0.79 LMNA (0.51) CA12CA1CA2CA7CA9
SCHEMBL10487681 0.79 FLT1 (0.52) CA12CA1CA2CA7CA9
SCHEMBL5954937 0.78 KDM4E (0.46) CA12CA1CA2CA7CA9
SCHEMBL28855330 0.77 CA12 (0.45) CA12CA1CA2CA7CA9
SCHEMBL15268121 0.76 TSHR (0.47) CA12CA1CA2CA7CA9
SCHEMBL4427513 0.75 RAB9A (0.45) CA12CA1CA2CA7CA9
SCHEMBL8733285 0.74 TSHR (0.69) TSHRKMT2AMEN1ALDH1A1MAPT

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-5427771-A Stable dispersion in cosmetically acceptable vehicle with adjuvants L'OREAL (FR) 1995-06-27 US claimed
US-5427771-A Stable dispersion in cosmetically acceptable vehicle with adjuvants L'OREAL (FR) 1995-06-27 US disclosed
US-5000937-A Transparent cosmetic composition that reflects infrared radiation and its use for protecting the human epidermis against infrared radiation L'OREAL (FR) 1991-03-19 US disclosed