SCHEMBL11041344

SCHEMBL11041344

CC1(C)Cc2cccc(NN)c2O1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
PKM P14618 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 2/20 0.40
NPC1 O15118 2/20 0.40
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38

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
Bicarbonate SCHEMBL10766647 0.92 LMNA (0.52) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL3331291 0.84 LMNA (0.52) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL28359008 0.78 LMNA (0.53) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL10741295 0.78 POLB (0.56) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL569823 0.77 LMNA (0.48) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL675157 0.75 LMNA (0.58) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL10766642 0.75 LMNA (0.51) LMNAPKMNPSR1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL11040640 0.75 LMNA (0.47) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL435089 0.74 LMNA (0.49) LMNAPKMNPSR1ALDH1A1MAPT
SCHEMBL11039178 0.74 LMNA (0.47) LMNAPKMNPSR1ALDH1A1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048040-B1 7-SUBSTITUTED 2,3-DIHYDROBENZOFURANS, THEIR PREPARATION AND THEIR USE AS PESTICIDES OR AS CHEMICAL INTERMEDIATES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-08-29 EP disclosed
US-4467104-A Esters of 2-(2-chlorocarbonyl)-2-(2,3-dihydro-2-alkylbenzofuran-7-yl)-hydrazinecarboxylic acid SHELL OIL COMPANY (US) 1984-08-21 US disclosed
US-4406910-A INSECTICIDES, MITICIDES SHELL OIL COMPANY (US) 1983-09-27 US disclosed
EP-0048040-A1 7-Substituted 2,3-dihydrobenzofurans, their preparation and their use as pesticides or as chemical intermediates SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1982-03-24 EP disclosed