SCHEMBL10636331

SCHEMBL10636331

OCc1ccc(F)cc1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.52
BCL2L1 Q07817 1/20 0.52
ALOX5 P09917 1/20 0.50
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL7008741 0.80 HTR2A (0.48) TSHRMEN1HPGDKMT2AHSD17B10
SCHEMBL3309883 0.80 IDO1 (0.40)
SCHEMBL31085527 0.80 IDO1 (0.40)
SCHEMBL9047865 0.79 MEN1 (0.62) BCL2BCL2L1ALOX5MEN1CYP3A4
SCHEMBL14415702 0.79 HTR2A (0.65) BCL2BCL2L1ALOX5HPGD
SCHEMBL4869623 0.79 MPO (0.45) KMT2A
SCHEMBL16192444 0.79 BCL2 (0.47) BCL2BCL2L1ALOX5MEN1CYP3A4
SCHEMBL3362041 0.79 ALOX5 (0.50) BCL2BCL2L1ALOX5HPGD
SCHEMBL10818489 0.78 MEN1 (0.66) BCL2BCL2L1ALOX5MEN1CYP3A4
SCHEMBL1773099 0.78 HTR2A (0.56) BCL2BCL2L1ALOX5TSHRMEN1

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
CN-112028756-B Synthesis method of 2-benzyl benzaldehyde derivative 齐鲁工业大学 2023-01-31 CN disclosed
CN-112028756-A Synthesis method of 2-benzyl benzaldehyde derivative 齐鲁工业大学 2020-12-04 CN disclosed
EP-0253536-A2 Fluorobenzyl esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-01-20 EP disclosed