SCHEMBL6790414

SCHEMBL6790414

O=C(O)Cc1ccc(-n2cccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 7/20 1.00
NSD2 O96028 1/20 1.00
GRK2 P25098 1/20 1.00
CASP6 P55212 1/20 1.00
CTDSP1 Q9GZU7 1/20 1.00
QPCT Q16769 1/20 0.65
AOC2 O75106 3/20 0.64
VHL P40337 1/20 0.59
ELOC Q15369 1/20 0.59
ELOB Q15370 1/20 0.59
AKR1B1 P15121 1/20 0.56
KLKB1 P03952 1/20 0.55
CTSB P07858 1/20 0.55
LMNA P02545 6/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 2/20 0.54
HTT P42858 2/20 0.53
ABCC4 O15439 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL11190157 0.82 POLB (0.70) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL3943549 0.78 QPCT (1.00) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL11984949 0.78 POLB (0.64) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL69614 0.78 CA2 (0.79) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL14210016 0.77 POLB (0.62) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL7434598 0.77 TBXAS1 (0.68) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL31716110 0.77 POLB (0.62) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL9742754 0.77 POLB (0.62) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL2472028 0.76 NSD2 (0.61) POLBNSD2GRK2CASP6CTDSP1
SCHEMBL11825850 0.75 POLB (0.60) POLBNSD2GRK2CASP6CTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0172147-B1 AMIDE DERIVATIVES OF 2-(P-AMINOBENZYL)-BUTYRIC ACID AND ESTERS THEREOF HAVING HYPOLIPIDEMIZING ACTIVITY Medosan Industrie Biochimiche Riunite S.r.l. (IT) 1992-06-03 EP claimed
EP-0172147-A2 Amide derivatives of 2-(p-aminobenzyl)-butyric acid and esters thereof having hypolipidemizing activity Medosan Industrie Biochimiche Riunite S.r.l. (IT) 1986-02-19 EP claimed
EP-4695240-A2 CYCLIC VINYL SULFONE WRN INHIBITORS Nimbus Wadjet, Inc. (US) 2026-02-18 EP disclosed
WO-2025245472-A1 COMPOUNDS AND RELATED METHODS USEFUL FOR DEGRADATION OF CYCLIN K AND INHIBITION OF CYCLIN DEPENDENT KINASES REMIX THERAPEUTICS INC. (US) 2025-11-27 WO disclosed
WO-2024215923-A2 CYCLIC VINYL SULFONE WRN INHIBITORS NIMBUS WADJET, INC. (US) 2024-10-17 WO disclosed
CN-100482647-C Pyrazole derivatives useful as COX-I inhibitors ASTELLAS PHARMACY CO LTD (JP) 2009-04-29 CN disclosed
CN-1717393-A Pyrazole derivatives as COX-1 inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 2006-01-04 CN disclosed
US-20040019046-A1 Phenylacetamido-pyrazole derivatives and their use as antitumor agents PHARMACIA ITALIA SPA (IT) 2004-01-29 US disclosed
EP-1345909-A1 PHENYLACETAMIDO-PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2003-09-24 EP disclosed
WO-2002048114-A1 PHENYLACETAMIDO- PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2002-06-20 WO disclosed
EP-0172147-B1 AMIDE DERIVATIVES OF 2-(P-AMINOBENZYL)-BUTYRIC ACID AND ESTERS THEREOF HAVING HYPOLIPIDEMIZING ACTIVITY Medosan Industrie Biochimiche Riunite S.r.l. (IT) 1992-06-03 EP disclosed
EP-0177659-B1 ESTER DERIVATIVES OF 7-(OMEGA-OXYALKYL) THEOPHYLLINE AND THEIR PHARMACEUTICAL ACTIVITY Medosan Industrie Biochimiche Riunite S.p.A. (IT) 1990-09-19 EP disclosed
US-4618612-A ANTICOAGULANTS, ANTIINFLAMMATORY AGENTS, BRONCHODILATOR AGENTS MEDOSAN INDUSTRIE BIOCHIMICHE RIUNITE S.P.A. (IT) 1986-10-21 US disclosed
EP-0177659-A1 Ester derivatives of 7-(omega-oxyalkyl) theophylline and their pharmaceutical activity Medosan Industrie Biochimiche Riunite S.p.A. (IT) 1986-04-16 EP disclosed
EP-0172147-A2 Amide derivatives of 2-(p-aminobenzyl)-butyric acid and esters thereof having hypolipidemizing activity Medosan Industrie Biochimiche Riunite S.r.l. (IT) 1986-02-19 EP disclosed
US-4563477-A Process for the preparation of alpha-(N-pyrrolyl)-derivative acids, the salts and esters thereof; alpha-(N-pyrrolyl)-phenylacetic acids, the esters thereof, pharmaceutical compositions containing them and therapeutical applications thereof ANTIBIOTICOS, S.A. (ES) 1986-01-07 US 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-20040019046-A1 Phenylacetamido-pyrazole derivatives and their use as antitumor agents DCK, CCNK, CDK2 POLB 631/4885NSD2 1481/4885GRK2 814/4885

“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.