SCHEMBL4983522

SCHEMBL4983522

COc1ccc(-c2c(OC)cccc2C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.57
FABP4 P15090 1/20 0.57
FABP5 Q01469 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.51
USP2 O75604 1/20 0.51
TP53 P04637 1/20 0.51
DDX3X O00571 1/20 0.50
HTT P42858 1/20 0.50
KDM4E B2RXH2 5/20 0.49
POLB P06746 3/20 0.49
ESR1 P03372 1/20 0.49
NR4A1 P22736 1/20 0.49
APEX1 P27695 1/20 0.49
PTPN7 P35236 1/20 0.49
RECQL P46063 1/20 0.49
BLM P54132 1/20 0.49
MCL1 Q07820 1/20 0.49
ESR2 Q92731 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL5845535 0.88 FABP4 (0.70) FABP3FABP4FABP5TP53HTT
SCHEMBL4988220 0.87 FABP3 (0.57) FABP3FABP4FABP5SMN1; SMN2TP53
SCHEMBL15782121 0.87 KDM4E (0.53) FABP3FABP4FABP5SMN1; SMN2KDM4E
SCHEMBL6718909 0.86 FABP4 (0.56) FABP3FABP4FABP5SMN1; SMN2HTT
SCHEMBL5937135 0.86 FABP3 (0.50) FABP3FABP4FABP5HTTCA1
SCHEMBL7786159 0.84 PDE10A (0.49) FABP3FABP4FABP5HTTCA1
SCHEMBL7463326 0.84 FABP3 (0.55) FABP3FABP4FABP5USP2TP53
SCHEMBL7796258 0.84 GPR35 (0.55) FABP3FABP4FABP5SMN1; SMN2TP53
SCHEMBL6797502 0.84 MYC (0.51) FABP4SMN1; SMN2USP2TP53DDX3X
SCHEMBL10873531 0.84 SMN1; SMN2 (0.51) SMN1; SMN2USP2TP53DDX3XKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 US disclosed
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 US disclosed
EP-1716137-A1 SUBSTITUTED QUINOLINE COMPOUNDS Pfizer Products Incorporated (US) 2006-11-02 EP disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 US disclosed
US-20050234099-A1 Substituted quinoline compounds PFIZER INC 2005-10-20 US disclosed
WO-2005080373-A1 SUBSTITUTED QUINOLINE COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-09-01 WO disclosed
US-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO 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 (4 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-20050234099-A1 Substituted quinoline compounds APOB, APOL1, MTPN FABP3 335/4885FABP4 26/4885FABP5 315/4885
US-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 FABP3 605/4885FABP4 1206/4885FABP5 1103/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 FABP3 598/4885FABP4 37/4885FABP5 530/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 FABP3 598/4885FABP4 37/4885FABP5 530/4885

“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.