SCHEMBL11258860

SCHEMBL11258860

COc1ccc(CNC2CC3(CCCC3)Oc3ccccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.44
KDM1A O60341 2/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
CTSD P07339 1/20 0.39
BACE1 P56817 1/20 0.39
NPY1R P25929 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL11285257 0.89 KMT2A (0.46) TRPV1KMT2ALMNACTSDBACE1
SCHEMBL11252670 0.87 TRPV1 (0.46) TRPV1KMT2ALMNAMAOAMAOB
SCHEMBL11245567 0.87 BACE1 (0.45) TRPV1KDM1AKMT2AMEN1LMNA
SCHEMBL11253779 0.87 SMPD1 (0.43) TRPV1KDM1AKMT2ALMNACTSD
SCHEMBL11245449 0.86 TRPV1 (0.45) TRPV1KMT2ALMNACTSDBACE1
SCHEMBL11245385 0.85 ALDH1A1 (0.44) KDM1AKMT2AMEN1LMNAMAOA
SCHEMBL11249928 0.85 TRPV1 (0.44) TRPV1KMT2ALMNATSHRCTSD
SCHEMBL11261454 0.84 TRPV1 (0.44) TRPV1KDM1AKMT2ACTSDBACE1
SCHEMBL11243369 0.84 OPRD1 (0.45) TRPV1KDM1AKMT2AMEN1TP53
SCHEMBL11474807 0.83 IDO1 (0.41) TRPV1KDM1AKMT2AMEN1TSHR

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
EP-0001428-B1 INSECTICIDAL AND ACARICIDAL AGENTS CONTAINING CHROMAN DERIVATIVES, THEIR PREPARATION AND THEIR USE, AS WELL AS CHROMAN DERIVATIVES AND THEIR PREPARATION BAYER AG (DE) 1982-03-24 EP disclosed
US-4238501-A INSECTICIDES, MITICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed
US-4237162-A MITICIDES, LARVACIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-02 US disclosed