SCHEMBL3475708

SCHEMBL3475708

O=C(O)c1cc(-c2ccc(F)cc2)cc(-c2ccc(F)cc2)c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.72
BAD Q92934 1/20 0.72
DHODH Q02127 4/20 0.53
PPARA Q07869 1/20 0.53
KMO O15229 1/20 0.50
EGFR P00533 1/20 0.50
MAP4K4 O95819 1/20 0.49
CA12 O43570 1/20 0.49
ALPL P05186 1/20 0.49
RPA1 P27694 1/20 0.49
RXRA P19793 3/20 0.48
RXRB P28702 3/20 0.48
RXRG P48443 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
AURKA O14965 1/20 0.47
TPX2 Q9ULW0 1/20 0.47
HCAR1 Q9BXC0 1/20 0.47

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
SCHEMBL15157461 0.96 BCL2L1 (0.72) BCL2L1BADDHODHPPARAMAP4K4
SCHEMBL28476726 0.87 BCL2L1 (0.60) BCL2L1BADDHODHPPARAMAP4K4
SCHEMBL4505786 0.87 BCL2L1 (0.60) BCL2L1BADDHODHPPARAMAP4K4
SCHEMBL4246903 0.86 DHODH (0.67) BCL2L1BADDHODHKMOEGFR
SCHEMBL18604547 0.86 DHODH (0.67) BCL2L1BADDHODHKMOEGFR
SCHEMBL133424 0.84 BCL2L1 (0.56) BCL2L1BADKDM4ELMNA
SCHEMBL15120764 0.84 EGFR (0.67) BCL2L1BADDHODHKMOEGFR
SCHEMBL202110 0.84 BCL2L1 (1.00) BCL2L1BADMAP4K4CA12RXRA
SCHEMBL21462308 0.84 RXRA (0.70) BCL2L1BADDHODHPPARARXRA
SCHEMBL15814719 0.84 DHODH (0.69) BCL2L1BADDHODHKMOEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010033168-A2 AMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF RENOVIS, INC. (US) 2010-03-25 WO claimed
US-11938114-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-03-26 US disclosed
US-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-05-13 US disclosed
US-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-05-13 US disclosed
US-10836706-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-11-17 US disclosed
US-10836706-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-11-17 US disclosed
US-20190055188-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2019-02-21 US disclosed
US-20190055188-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2019-02-21 US disclosed
US-9926261-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-03-27 US disclosed
US-9926261-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-03-27 US disclosed
WO-2017147335-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2017-08-31 WO disclosed
US-20160271082-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-09-22 US disclosed
US-20160271082-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-09-22 US disclosed
EP-1917262-B1 PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X3 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2011-12-14 EP disclosed
WO-2010033168-A2 AMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF RENOVIS, INC. (US) 2010-03-25 WO disclosed
US-7491821-B2 2-(4-fluorophenyl)-4-propyl-oxazole-5-carboxylic acid {2-[4-(6-aminopyridin-2-yl)-piperazin-1-yl]-1-methyl-ethyl}amide; purinergic receptor antagonists, analgesics; urogenital, gastointestinal and respiratory system disorders ROCHE PALO ALTO LLC (US) 2009-02-17 US disclosed
EP-1917262-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X3 ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2008-05-07 EP disclosed
WO-2007020194-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X3 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2007-02-22 WO disclosed
US-20070037974-A1 Inhibitors of P2X3 ROCHE PALO ALTO LLC 2007-02-15 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 (6 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-20070037974-A1 Inhibitors of P2X3 P2RX3, P2RX4, P2RX5 BCL2L1 4151/4885BAD 3842/4885DHODH 2745/4885
US-11938114-B2 Bacterial efflux pump inhibitors ABCB11, ABCB1, SLC47A1 BCL2L1 2992/4885BAD 4814/4885DHODH 970/4885
US-10836706-B2 Bacterial efflux pump inhibitors ABCB11, ABCB1, SLC47A1 BCL2L1 2992/4885BAD 4814/4885DHODH 970/4885
US-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS ABCB11, ABCB1, SLC47A1 BCL2L1 2992/4885BAD 4814/4885DHODH 970/4885
US-20190055188-A1 BACTERIAL EFFLUX PUMP INHIBITORS ABCB11, ABCB1, SLC47A1 BCL2L1 2992/4885BAD 4814/4885DHODH 970/4885
US-20160271082-A1 BACTERIAL EFFLUX PUMP INHIBITORS ABCB11, ABCB1, SLC47A1 BCL2L1 2957/4885BAD 4788/4885DHODH 908/4885

“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.