SCHEMBL11387702

SCHEMBL11387702

Oc1ccccc1/C=C/c1ccon1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE2 P0DPD6 2/20 0.50
MEN1 O00255 3/20 0.49
NPC1 O15118 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CASP3 P42574 2/20 0.49
SENP8 Q96LD8 2/20 0.49
SENP7 Q9BQF6 2/20 0.49
SENP6 Q9GZR1 2/20 0.49
TRPA1 O75762 1/20 0.48
NFKB1 P19838 2/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
JUN P05412 1/20 0.43
NFE2L2 Q16236 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
MAPT P10636 3/20 0.41

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
SCHEMBL11387706 1.00 ECE2 (0.50) ECE2MEN1NPC1KMT2ALMNA
SCHEMBL108389 0.76 TRPA1 (0.76) ECE2MEN1NPC1KMT2ALMNA
SCHEMBL717976 0.76 TRPA1 (0.76) ECE2MEN1NPC1KMT2ALMNA
SCHEMBL5038547 0.73 MEN1 (0.54) MEN1NPC1KMT2ALMNASMN1; SMN2
SCHEMBL6982031 0.73 MEN1 (0.54) MEN1NPC1KMT2ALMNASMN1; SMN2
SCHEMBL708945 0.72 NPC1 (0.64) ECE2MEN1NPC1KMT2ATRPA1
SCHEMBL708946 0.72 NPC1 (0.64) ECE2MEN1NPC1KMT2ATRPA1
SCHEMBL11388911 0.71 ECE2 (0.46) ECE2MEN1NPC1KMT2ALMNA
SCHEMBL11388913 0.71 ECE2 (0.46) ECE2MEN1NPC1KMT2ALMNA
Hydrochloric Acid SCHEMBL16915472 0.70 NPC1 (0.61) ECE2MEN1NPC1KMT2ATRPA1

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
EP-0034754-A1 2-((3-amino-2-hydroxy-propoxy)-styryl) isoxazoles, process for their preparation and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1981-09-02 EP disclosed
EP-0034754-A1 2-((3-amino-2-hydroxy-propoxy)-styryl) isoxazoles, process for their preparation and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1981-09-02 EP disclosed
US-4251539-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS BASF AKTIENGESELLSCHAFT (DE) 1981-02-17 US disclosed
EP-0005186-A1 3-Alkyl-5-(2-hydroxystyryl)-isoxazoles and process for their preparation BASF Aktiengesellschaft (DE) 1979-11-14 EP disclosed
EP-0005192-A1 Alkylaminopropanol derivatives of 3-alkyl-5-(2-hydroxystyryl)-isoxazoles, processes for their preparation and therapeutical compositions containing them BASF Aktiengesellschaft (DE) 1979-11-14 EP disclosed