SCHEMBL9636835

SCHEMBL9636835

O=C(O)c1cc2ccccc2c([N+](=O)[O-])c1C(=O)OC(=O)c1c(C(=O)O)cc2ccccc2c1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.53
▸ CDK2 P24941 2/20 0.45
▸ GPR35 Q9HC97 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ NCEH1 Q6PIU2 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ ANO1 Q5XXA6 1/20 0.41
▸ ANO2 Q9NQ90 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ CASP6 P55212 1/20 0.40

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
SCHEMBL9827265 0.88 CYP3A4 (0.59) CYP3A4CDK2GPR35MEN1KMT2A
SCHEMBL9558553 0.80 CYP3A4 (0.59) CYP3A4CDK2GPR35MEN1KMT2A
SCHEMBL5836018 0.80 CYP3A4 (0.59) CYP3A4CDK2GPR35MEN1KMT2A
SCHEMBL6432594 0.79 ALDH1A1 (0.59) GPR35MEN1KMT2AALDH1A1KDM4E
SCHEMBL5837648 0.78 CYP3A4 (0.57) CYP3A4CDK2GPR35MEN1KMT2A
SCHEMBL11412760 0.77 CYP3A4 (0.51) CYP3A4CDK2MEN1KMT2AALDH1A1
SCHEMBL11649931 0.77 CASP6 (0.53) CYP3A4CDK2MEN1KMT2AALDH1A1
SCHEMBL2359474 0.77 CYP3A4 (0.59) CYP3A4CDK2MEN1KMT2AALDH1A1
SCHEMBL12192755 0.77 CDK2 (0.56) CYP3A4CDK2GPR35MEN1KMT2A
SCHEMBL5836826 0.76 CYP3A4 (0.50) CYP3A4CDK2GPR35MEN1KMT2A

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5110880-A Molding materials having good stress crack resistance AMOCO CORPORATION (US) 1992-05-05 — — US disclosed
US-5093435-A Blend of amorphous and crystalline thermoplastic resins as dielectric material AMOCO CORPORATION (US) 1992-03-03 — — US disclosed
EP-0170065-B1 MOLDED ELECTRICAL DEVICE, MOLDED CIRCUIT BOARD SUBSTRATE AND MOLDED CHIP CARRIER AMOCO CORPORATION (US) 1989-12-20 — — EP disclosed
US-4877682-A OUTSIDE SHEETS HAVE HIGHER STIFFNESS AMOCO CORPORATION (US) 1989-10-31 — — US disclosed
EP-0263854-A4 LAMINATES CONTAINING COEXTRUDED SCRAP. AMOCO CORP (US) 1988-11-02 — — EP disclosed
US-4772653-A Stain resistant cookware from blends comprising an interpolymer of an unsaturated dicarboxylic acid compound AMOCO CORPORATION (US) 1988-09-20 — — US disclosed
EP-0117539-B1 IMPROVED PROCESS FOR TREATING THERMOPLASTIC POLYMERS AMOCO CORPORATION (US) 1988-08-17 — — EP disclosed
EP-0263854-A1 LAMINATES CONTAINING COEXTRUDED SCRAP AMOCO CORPORATION (US) 1988-04-20 — — EP disclosed
US-4737389-A AT LEAST THREE SHEETS MADE FROM THERMOPLASTIC RESIN INSIDE SHEET BEING AMORPHOUS AND HAVING LOWER USE TEMPERATURE AMOCO CORPORATION (US) 1988-04-12 — — US disclosed
US-4720540-A PEROXY COMPOUND AMOCO CORPORATION (US) 1988-01-19 — — US disclosed
EP-0130462-A2 Printed circuits AMOCO CORPORATION (US) 1985-01-09 — — EP disclosed
EP-0127852-A1 Cookware made from polyarylethersulfone AMOCO CORPORATION (US) 1984-12-12 — — EP disclosed
EP-0120502-A2 Process for treating polyarylates AMOCO CORPORATION (US) 1984-10-03 — — EP disclosed
EP-0117539-A2 Improved process for treating thermoplastic polymers AMOCO CORPORATION (US) 1984-09-05 — — EP disclosed
EP-0033394-B1 MOLDING COMPOSITION CONSISTING OF POLY(ARYLETHER) RESINS AND POLYETHERIMIDE RESINS UNION CARBIDE CORPORATION (US) 1984-04-11 — — EP disclosed
EP-0097969-A1 A plasticized thermoplastic polymer AMOCO CORPORATION (US) 1984-01-11 — — EP disclosed
US-4293670-A CRACK RESISTANCE, MOLDING MATERIALS UNION CARBIDE CORPORATION (US) 1981-10-06 — — US disclosed
EP-0033394-A1 Molding composition consisting of poly(arylether) resins and polyetherimide resins UNION CARBIDE CORPORATION (US) 1981-08-12 — — EP disclosed
EP-0033011-A1 Polyarylate blends with polyetherimides UNION CARBIDE CORPORATION (US) 1981-08-05 — — EP disclosed
US-4250279-A MOLDING MATERIALS UNION CARBIDE CORPORATION (US) 1981-02-10 — — US disclosed
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