SCHEMBL9856912

SCHEMBL9856912

COc1ccc(C(=O)c2cccc3ccccc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 3/20 0.67
KMT2A Q03164 2/20 0.62
BCL2 P10415 1/20 0.59
MCL1 Q07820 1/20 0.59
BAD Q92934 1/20 0.59
CNR2 P34972 2/20 0.59
CNR1 P21554 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
NPC1 O15118 2/20 0.58
TP53 P04637 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
MTNR1A P48039 1/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
CDC25B P30305 2/20 0.51
PLK1 P53350 1/20 0.51
MAOB P27338 1/20 0.51

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
SCHEMBL6103170 0.86 CDC25B (0.57) GCGRKMT2ABCL2MCL1BAD
SCHEMBL6750240 0.83 RAB9A (0.54) GCGRKMT2ACNR2CNR1SMN1; SMN2
SCHEMBL16538479 0.83 KMT2A (0.65) GCGRKMT2ABCL2MCL1BAD
SCHEMBL18288071 0.83 SMN1; SMN2 (0.55) GCGRKMT2ASMN1; SMN2NPC1TP53
SCHEMBL16510400 0.82 GCGR (0.53) GCGRKMT2ABCL2MCL1BAD
SCHEMBL2681767 0.82 ALDH1A1 (0.54) GCGRKMT2ACNR2SMN1; SMN2NPC1
SCHEMBL10661918 0.81 AKR1C3 (0.61) GCGRKMT2ABCL2MCL1BAD
SCHEMBL547632 0.81 CDC25B (0.69) GCGRKMT2ABCL2MCL1BAD
SCHEMBL29522736 0.81 CDC25B (0.69) GCGRKMT2ABCL2MCL1BAD
SCHEMBL16549911 0.81 RAB9A (0.51) GCGRKMT2ACNR2CNR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110483223-B Method for preparing diaryl ketone compound by high-efficiency catalysis of palladium pyridine 陕西师范大学 2022-06-07 CN disclosed
US-9994515-B2 Aryl naphthyl methanone oxime(s) and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2018-06-12 US disclosed
EP-3039010-B1 ARYL NAPHTHYL METHANONE OXIME(S) AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2017-10-11 EP disclosed
US-20160304442-A1 ARYL NAPHTHYL METHANONE OXIME(S) AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-10-20 US disclosed
EP-3039010-A1 ARYL NAPHTHYL METHANONE OXIME(S) AND PROCESS FOR PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2016-07-06 EP disclosed
WO-2015029068-A1 ARYL NAPHTHYL METHANONE OXIME(S) AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-03-05 WO disclosed
EP-0426846-A1 FLUORINATED-AROMATIC SULFONIC ACID CATALYST, PROCESS FOR ITS PRODUCTION, AND ITS USE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-05-15 EP disclosed
CN-1040332-A Fluorine-containing aromatic sulfonic acid catalyzer and method for making and purposes MITSUI PETROCHEMICAL IND (JP) 1990-03-14 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160304442-A1 ARYL NAPHTHYL METHANONE OXIME(S) AND PROCESS FOR PREPARATION THEREOF MCL1, CYP11B1, CYP21A2 GCGR 3227/4885KMT2A 786/4885BCL2 399/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.