SCHEMBL9735180

SCHEMBL9735180

COCC1(C)Oc2ccc(Br)cc2C(Oc2ccc(=O)n(C)n2)C1O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 7/20 0.33
TRPV1 Q8NER1 1/20 0.32
XIAP P98170 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HIF1A Q16665 1/20 0.31
BACE1 P56817 1/20 0.31
IDO1 P14902 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
AXL P30530 2/20 0.31
TYRO3 Q06418 2/20 0.31
MERTK Q12866 2/20 0.31

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
SCHEMBL9740513 0.91 HTR2B (0.33) HTR2BTRPV1PKMSMN1; SMN2HIF1A
SCHEMBL8541429 0.90 MAPT (0.33) HTR2BPKMSMN1; SMN2HIF1AMAPT
SCHEMBL7332443 0.87 ABCC9 (0.36) HTR2BTRPV1PKMSMN1; SMN2HIF1A
SCHEMBL9735341 0.86 ABCC9 (0.41) MEN1KMT2AAXLTYRO3MERTK
SCHEMBL9735710 0.86 AXL (0.34) TRPV1SMN1; SMN2IDO1MEN1ALDH1A1
SCHEMBL9736573 0.86 MAPT (0.36) SMN1; SMN2HIF1AMEN1ALDH1A1KMT2A
SCHEMBL9741124 0.83 HTR2B (0.33) HTR2BTRPV1PKMSMN1; SMN2HIF1A
SCHEMBL9736485 0.82 IDO1 (0.32) XIAPSMN1; SMN2IDO1
SCHEMBL9737313 0.81 PKM (0.31) HTR2BPKMSMN1; SMN2HIF1ABACE1
SCHEMBL9739946 0.79 AXL (0.33) TRPV1SMN1; SMN2IDO1MEN1ALDH1A1

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-5130322-A CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-07-14 US disclosed
EP-0415065-A1 Chroman derivatives MERCK PATENT GmbH (DE) 1991-03-06 EP disclosed