SCHEMBL2583085

SCHEMBL2583085

C=CCNc1cc2ccccc2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 2/20 0.55
TP53 P04637 2/20 0.55
NFKB1 P19838 2/20 0.55
RAB9A P51151 2/20 0.55
NFKB2 Q00653 2/20 0.55
RELA Q04206 2/20 0.55
MAPT P10636 2/20 0.55
CYP2A6 P11509 2/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
ALOX12 P18054 2/20 0.40
AGXT P21549 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 1/20 0.37
MITF O75030 1/20 0.37
NSD2 O96028 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL4077096 0.78 LMNA (0.57) ALDH1A1KDM4ESMN1; SMN2NPC1TP53
SCHEMBL5383838 0.77 LOXL2 (0.42) ALDH1A1KDM4ESMN1; SMN2NPC1TP53
SCHEMBL140394 0.77 NPC1 (0.51) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL9826526 0.75 NPC1 (0.50) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL11869069 0.75 ALDH1A1 (0.41) ALDH1A1KDM4ESMN1; SMN2NPC1TP53
SCHEMBL9826049 0.74 MAOB (0.51) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL1062947 0.74 HPGD (0.54) ALDH1A1SMN1; SMN2NPC1TP53NFKB1
SCHEMBL8158782 0.74 RECQL (0.46) ALDH1A1KDM4ESMN1; SMN2TP53MAPT
SCHEMBL7699924 0.74 FLT3 (0.48) ALDH1A1KDM4ESMN1; SMN2NPC1TP53
SCHEMBL28643561 0.73 CYP2A6 (0.47) ALDH1A1KDM4ESMN1; SMN2NPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2552900-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI (FR) 2013-02-06 EP claimed
WO-2011121245-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI-AVENTIS (FR) 2011-10-06 WO claimed
EP-0283522-B1 TRIAZINE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING SAME AS EFFECTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-02-27 EP claimed
EP-0216259-B1 TRIAZINE DERIVATIVES, A PROCESS FOR PREPARATION OF THE DERIVATIVES, AND HERBICIDES CONTAINING THE DERIVATIVES AS THE EFFECTIVE COMPONENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-02-28 EP claimed
EP-0283522-A1 TRIAZINE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING SAME AS EFFECTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-09-28 EP claimed
EP-0216259-A1 Triazine derivatives, a process for preparation of the derivatives, and herbicides containing the derivatives as the effective component IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-04-01 EP claimed
EP-2552900-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI (FR) 2013-02-06 EP disclosed
WO-2011121245-A1 PROCESS FOR PREPARING AMINOBENZOFURAN DERIVATIVES SANOFI-AVENTIS (FR) 2011-10-06 WO disclosed
WO-2003048144-A3 METHOD FOR MONOSULPHONYLATION OF AN AMINOBENZOFURAN COMPOUND RHODIA CHIMIE SA (FR) 2003-12-11 WO disclosed
WO-2003048144-A2 METHOD FOR MONOSULPHONYLATION OF AN AMINOBENZOFURAN COMPOUND RHODIA CHIMIE (FR) 2003-06-12 WO disclosed
EP-0283522-B1 TRIAZINE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING SAME AS EFFECTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-02-27 EP disclosed
US-4932998-A LOW PHYTOTOXICITY FOR PADDY RICE PLANTS IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0216259-B1 TRIAZINE DERIVATIVES, A PROCESS FOR PREPARATION OF THE DERIVATIVES, AND HERBICIDES CONTAINING THE DERIVATIVES AS THE EFFECTIVE COMPONENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-02-28 EP disclosed
EP-0283522-A1 TRIAZINE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING SAME AS EFFECTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-09-28 EP disclosed
US-4740230-A Triazine derivatives, and herbicides containing the derivatives as the effective component IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-04-26 US disclosed
EP-0216259-A1 Triazine derivatives, a process for preparation of the derivatives, and herbicides containing the derivatives as the effective component IDEMITSU KOSAN COMPANY LIMITED (JP) 1987-04-01 EP disclosed
EP-0029311-B1 AMINOALKYL BENZOFURAN DERIVATIVES, THEIR PRODUCTION AND COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1985-01-23 EP disclosed
EP-0029311-A1 Aminoalkyl benzofuran derivatives, their production and compositions containing them MERCK & CO. INC. (US) 1981-05-27 EP disclosed