SCHEMBL9212246

SCHEMBL9212246

NCCS(=O)(=O)CCc1ccco1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ POLB P06746 4/20 0.37
▸ TSHR P16473 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HSD17B10 Q99714 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
SCHEMBL28198347 0.79 CA12 (0.45) CA12CA1CA2CA4ALDH1A1
SCHEMBL592514 0.76 — —
SCHEMBL4016314 0.76 EPHX2 (0.42) CA12CA1CA2CA4ALDH1A1
Hydrochloric Acid SCHEMBL7329430 0.74 — —
SCHEMBL1025242 0.72 — —
SCHEMBL3839583 0.71 ALDH1A1 (0.56) ALDH1A1ALOX15HPGDTDP1ALOX5
SCHEMBL8146532 0.71 ALDH1A1 (0.54) ALDH1A1ALOX15HPGDTDP1ALOX5
SCHEMBL3217679 0.69 ALDH1A1 (0.59) ALDH1A1ALOX15HPGDTDP1ALOX5
SCHEMBL4021962 0.69 ALDH1A1 (0.46) CA12CA1CA2CA4ALDH1A1
SCHEMBL4013943 0.68 ALDH1A1 (0.49) CA12CA1CA2CA4ALDH1A1

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-0492178-B1 Naphthoic acid derivative FUJIREBIO KK (JP) 1995-10-04 — — EP disclosed
US-5324728-A Lipoxygenase inhibiting antiallergens FUJIREBIO INC. (JP) 1994-06-28 — — US disclosed
EP-0492178-A2 Naphthoic acid derivative FUJIREBIO INC. (JP) 1992-07-01 — — EP disclosed
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