SCHEMBL9051012

SCHEMBL9051012

C=C(c1ccccc1C(=C)C(C)Cl)C(C)Cl

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
XBP1 P17861 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
ALOX15 P16050 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL4021295 0.78 LMNA (0.47) ALDH1A1KMT2AMAPTLMNAXBP1
SCHEMBL11007604 0.77 PTK2B (0.40) ALDH1A1KMT2AMAPTLMNANPSR1
SCHEMBL9522019 0.69 CES2 (0.47) ALDH1A1L3MBTL1CES2CES1
SCHEMBL9522007 0.69 CES2 (0.47) ALDH1A1L3MBTL1CES2CES1
SCHEMBL29338496 0.69 GABRA1 (0.35) MAPTLMNAXBP1ATMSMN1; SMN2
SCHEMBL14957087 0.67 GABRA1 (0.34) LMNATSHRGABRA1GABRB2
SCHEMBL23836627 0.67 MAPT (0.46) ALDH1A1MAPTLMNAXBP1ATM
SCHEMBL9524578 0.67 CES2 (0.41) ALDH1A1KMT2AMAPTLMNAATM
SCHEMBL9626470 0.67 MEN1 (0.45) ALDH1A1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL9522141 0.67 CES2 (0.41) ALDH1A1KMT2AMAPTLMNAATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5491189-A BINDER DISPERSION CONSISTS OF A HALOGENATED COPOLYMER OF 2,3-DIHALO-1,3-BUTADIENE, AROMATIC MONOALKYENE ALKYL HALIDE, UNSATURATED OLEFIN, AND CONTAINS ADDITIVE, PARTLY SAPONIFIED VINYL ACETATE COPOLYMER, AROMATIC POLYNITROSO COMPOUNDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1996-02-13 US disclosed
EP-0470105-B1 AQUEOUS VULCANIZING ADHESIVE HENKEL KGAA (DE) 1994-07-27 EP disclosed
EP-0470105-A1 AQUEOUS VULCANIZING ADHESIVE. HENKEL KGAA (DE) 1992-02-12 EP disclosed
WO-1990012847-A1 AQUEOUS VULCANIZING ADHESIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1990-11-01 WO disclosed
EP-0161373-B1 AQUEOUS ADHESIVE FOR BONDING RUBBER BY VULCANISATION TO A SUBSTRATE Henkel Kommanditgesellschaft auf Aktien (DE) 1988-03-02 EP disclosed