SCHEMBL11152251

SCHEMBL11152251

O=C1C(=O)N(CCCCl)c2cc(F)ccc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PARK7 Q99497 3/20 0.49
▸ NSD2 O96028 1/20 0.45
▸ CES1 P23141 4/20 0.44
▸ BCHE P06276 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ ALDH2 P05091 2/20 0.43
▸ ALDH3A1 P30838 2/20 0.43
▸ CHRM5 P08912 2/20 0.43
▸ CDC25A P30304 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ POLB P06746 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ KDM4E B2RXH2 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
SCHEMBL11150483 0.88 PARK7 (0.63) PARK7NSD2ALDH1A1ALDH3A1CHRM5
SCHEMBL7833229 0.78 PARK7 (0.67) PARK7NSD2ALDH1A1ALDH2ALDH3A1
SCHEMBL28547209 0.78 PARK7 (0.71) PARK7NSD2CES1ALDH1A1ALDH2
SCHEMBL2149622 0.78 CES1 (0.73) PARK7CES1BCHEALDH1A1ALDH2
SCHEMBL28547202 0.76 PARK7 (0.69) PARK7NSD2CES1ALDH1A1ALDH2
SCHEMBL28546572 0.76 PARK7 (0.69) PARK7NSD2CES1ALDH1A1ALDH2
SCHEMBL28539851 0.76 PARK7 (0.69) PARK7NSD2CES1ALDH1A1ALDH2
SCHEMBL28533459 0.76 PARK7 (0.69) PARK7NSD2CES1ALDH1A1ALDH2
SCHEMBL12930212 0.76 ALDH1A1 (0.67) PARK7CES1BCHEALDH1A1ALDH2
SCHEMBL18954583 0.75 ALDH1A1 (0.47) PARK7CES1ALDH1A1ALDH2ALDH3A1

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-4382934-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-05-10 — — US disclosed
EP-0010398-B1 ISATIN DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-27 — — EP disclosed
EP-0010398-A1 Isatin derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-04-30 — — EP disclosed
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