SCHEMBL11482014

SCHEMBL11482014

c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2NCc1cccc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.40
ADRA1D P25100 2/20 0.39
ADRA1A P35348 2/20 0.39
ADRA1B P35368 2/20 0.39
KMT2A Q03164 2/20 0.39
OPRD1 P41143 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
IDO1 P14902 1/20 0.35
EPHX1 P07099 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL11253871 1.00 TRPV1 (0.40) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11483393 1.00 TRPV1 (0.40) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11481490 0.99 TRPV1 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11245250 0.99 TRPV1 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11472524 0.99 TRPV1 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11239291 0.87 TRPV3 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11481605 0.87 TRPV3 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11473484 0.87 TRPV3 (0.41) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11481564 0.87 KMT2A (0.38) TRPV1ADRA1DADRA1AADRA1BKMT2A
SCHEMBL11250576 0.87 KMT2A (0.38) TRPV1ADRA1DADRA1AADRA1BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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