SCHEMBL7732923

SCHEMBL7732923

Cc1ccc(Oc2cc(-c3ccc(C#N)cc3)oc2-c2ccc(C#N)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 3/20 0.51
▸ TP53 P04637 3/20 0.47
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP2A6 P11509 1/20 0.43
▸ MAPT P10636 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ TBXA2R P21731 2/20 0.38
▸ KDM1A O60341 1/20 0.38
▸ MAOB P27338 2/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ TNKS O95271 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ PTGER4 P35408 1/20 0.37
▸ PTPN1 P18031 1/20 0.36

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
SCHEMBL7734244 0.82 MAOB (0.47) ALDH1A1SMN1; SMN2MAOBPTPN1KCNH2
SCHEMBL7732934 0.80 CTDSP1 (0.45) ARALDH1A1MAPTSMN1; SMN2CYP3A4
SCHEMBL8866488 0.78 AR (0.50) ARTP53ALDH1A1CYP2A6TBXA2R
SCHEMBL31070291 0.76 ALDH1A1 (0.64) ARTP53ALDH1A1CYP2A6MAPT
SCHEMBL5310372 0.75 NISCH (0.56) ALDH1A1CASP1CASP7MAOB
SCHEMBL459019 0.74 ALDH1A1 (0.73) ARTP53ALDH1A1CYP2A6MAPT
SCHEMBL6465427 0.74 NISCH (0.55) ALDH1A1CYP3A4MAOBPTPN1KCNH2
SCHEMBL922953 0.73 AR (0.62) ARALDH1A1CYP2A6TBXA2RSLC6A4
SCHEMBL9079937 0.71 AR (0.44) ARALDH1A1
SCHEMBL7735081 0.70 PTGS1 (0.32) MAOBPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792271-B1 FURAN DERIVATIVES FOR INHIBITING PNEUMOCYSTIS CARINII PNEUMONIA, GIARDIA LAMBLIA AND CRYPTOSPORIDIUM PARVUM UNIV GEORGIA STATE RES FOUND (US) 2002-02-27 — — EP disclosed
US-5723288-A Method of fluorescent detection of nucleic acids and cytoskeleton elements using bis-dicationic aryl furans, and kits useful therefor THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1998-03-03 — — US disclosed
US-5667975-A Method of fluorescent detection of nucleic acids and cytoskeleton elements using bis-dicationic aryl furans THE UNIVERSITY OF NORTH CAROLINA 1997-09-16 — — US disclosed
EP-0792271-A1 FURAN DERIVATIVES FOR INHIBITING PNEUMOCYSTIS CARINII PNEUMONIA, GIARDIA LAMBLIA AND CRYPTOSPORIDIUM PARVUM GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 1997-09-03 — — EP disclosed
US-5602172-A USING A 2,5-DIPHENYLFURAN COMPOUND THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1997-02-11 — — US disclosed
US-5594138-A MEDICAL DIAGNOSIS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 1997-01-14 — — US disclosed
WO-1996015126-A1 FURAN DERIVATIVES FOR INHIBITING PNEUMOCYSTIS CARINII PNEUMONIA, GIARDIA LAMBLIA AND CRYPTOSPORIDIUM PARVUM GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 1996-05-23 — — WO disclosed
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