SCHEMBL7796054

SCHEMBL7796054

Nc1ccc2oc(CCC(=O)O)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.54
FFAR1 O14842 8/20 0.51
FFAR4 Q5NUL3 7/20 0.51
CYP2C9 P11712 1/20 0.48
CACNA1C Q13936 1/20 0.48
F2 P00734 1/20 0.45
F10 P00742 1/20 0.45
CA2 P00918 1/20 0.44
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DRD2 P14416 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL7799417 0.83 FFAR4 (0.52) FLT3FFAR1FFAR4CYP2C9CACNA1C
SCHEMBL7795543 0.81 TBXAS1 (0.53) FFAR1FFAR4CYP2C9CACNA1CF2
SCHEMBL27511219 0.80 FLT3 (0.47) FLT3FFAR1FFAR4F2F10
Hydrochloric Acid SCHEMBL6983719 0.79 FLT3 (0.46) FLT3FFAR1FFAR4F2F10
SCHEMBL7248298 0.79 LOXL2 (0.53) FLT3FFAR1FFAR4CYP2C9CACNA1C
SCHEMBL5221517 0.78 HRH3 (0.49) FFAR1FFAR4CYP2C9CACNA1C
SCHEMBL8179634 0.77 TLR8 (0.47) FLT3F2F10CA2NPC1
SCHEMBL27841947 0.77 MAOA (0.56) FFAR1FFAR4CYP2C9CACNA1CCA2
SCHEMBL4689215 0.76 FLT3 (0.55) FLT3F2F10CA2NPC1
SCHEMBL16329628 0.76 FLT3 (0.56) FLT3F2F10CA2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103044370-A Preparation method of 5-(piperazinyl-1-yl) benzofuranyl-2-carboxamide SHANDONG ZOUPING DAZHAN NEW MATERIALS CO LTD 2013-04-17 CN disclosed
US-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 US disclosed
US-6159964-A Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-12-12 US disclosed
EP-0895475-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2000-08-23 EP disclosed
EP-0906103-A4 1999-04-07 EP disclosed
EP-0906103-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-04-07 EP disclosed
EP-0895475-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-10 EP disclosed
US-5739350-A COMPOUNDS CAPABLE OF BEING LINKED TO MONOCLONAL ANTIBODIES FOR DELIVERY TO TARGET CELLS PHARMACIA & UPJOHN COMPANY (US) 1998-04-14 US disclosed
WO-1997024122-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed
WO-1997024124-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed
EP-0527189-A1 NOVEL CC-1065 ANALOGS PHARMACIA & UPJOHN COMPANY (US) 1993-02-17 EP disclosed
WO-1991016324-A1 NOVEL CC-1065 ANALOGS THE UPJOHN COMPANY (US) 1991-10-31 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 (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-20010034445-A1 Vitronectin receptor antagonists ADGRF1, GPR174, CALCRL FLT3 3049/4885FFAR1 108/4885FFAR4 386/4885

“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.