SCHEMBL902965

SCHEMBL902965

OCOC=Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
IDO1 P14902 2/20 0.42
PAM P19021 2/20 0.42
LMNA P02545 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
PLIN1 O60240 1/20 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
SCHEMBL1891350 0.83 ALDH1A1 (0.43) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL13686299 0.81 MAOB (0.48) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL13899910 0.81 MAOB (0.48) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL17425906 0.78 CYP2C19 (0.38) MAOBLMNAALDH1A1CYP1A2CYP2D6
SCHEMBL17893044 0.78 IDO1 (0.33) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL25245587 0.77 MAOB (0.44) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL10385527 0.77 MAOB (0.50) MAOBIDO1PAMLMNAALDH1A1
SCHEMBL60042 0.77 RELA (0.53) MAOBIDO1LMNAALDH1A1CYP1A2
SCHEMBL17836905 0.77 RELA (0.53) MAOBIDO1LMNAALDH1A1CYP1A2
SCHEMBL6726710 0.77 MAOB (0.44) MAOBIDO1PAMLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119173616-A Recovery of novel low sulfur terpene mixtures from wood processing 弗门尼舍有限公司 2024-12-20 CN disclosed
WO-2012042541-A2 METHOD FOR PREDICTING AND MODELING ANTI-PSYCHOTIC ACTIVITY USING VIRTUAL SCREENING MODEL COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-04-05 WO disclosed
CN-1130451-C Delivery system having release inhibitor loaded zeolite and method for making same PROCTER & GAMBLE (US) 2003-12-10 CN disclosed
CN-1128868-C Delivery system having release barries loaded zeolite PROCTER & GAMBLE (US) 2003-11-26 CN disclosed
CN-1219957-A Delivery system comprising a release inhibitor loaded zeolite and method for making the delivery system PROCTER & GAMBLE (US) 1999-06-16 CN disclosed
CN-1219194-A Delivery system comprising a release barrier loaded zeolite PROCTER & GAMBLE (US) 1999-06-09 CN disclosed