SCHEMBL2926701

SCHEMBL2926701

O=[N+]([O-])c1ccc2c(Cl)n[nH]c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
HPGD P15428 2/20 0.50
DAO P14920 1/20 0.50
CYP3A4 P08684 2/20 0.49
NOS1 P29475 2/20 0.49
LMNA P02545 2/20 0.49
ALOX15 P16050 1/20 0.49
PARP1 P09874 1/20 0.47
NAMPT P43490 1/20 0.46
XDH P47989 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 2/20 0.45
MAOB P27338 1/20 0.45
GRIA1 P42261 1/20 0.45
GRIA2 P42262 1/20 0.45
GRIA3 P42263 1/20 0.45
GRIA4 P48058 1/20 0.45
MAP2K7 O14733 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL27671365 0.98 MAPT (0.49) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL760760 0.87 MAPT (0.61) MAPTHPGDCYP3A4NOS1LMNA
SCHEMBL2931498 0.81 JAK2 (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL921416 0.81 DAO (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL29431208 0.81 JAK2 (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL30833662 0.81 DAO (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL2595091 0.80 MAPT (0.50) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL588431 0.80 PARP1 (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL445096 0.80 MAPT (0.50) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL29395331 0.80 MAPT (0.50) MAPTHPGDDAOCYP3A4NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3933498-A Fogged, direct positive silver halide emulsions containing a bleach inhibiting compound and a Dmin maintainer compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-01-20 US claimed
CN-110536885-B Process for producing difluoromethylene compound 佐藤制药株式会社 2024-03-08 CN disclosed
US-11084792-B2 Method for producing difluoromethylene compound SATO PHARMACEUTICAL CO., LTD. (JP) 2021-08-10 US disclosed
US-20200190038-A1 METHOD FOR PRODUCING DIFLUOROMETHYLENE COMPOUND SATO PHARMACEUTICAL CO., LTD. (JP) 2020-06-18 US disclosed
EP-3617197-A1 METHOD FOR PRODUCING DIFLUOROMETHYLENE COMPOUND Sato Pharmaceutical Co., Ltd. (JP) 2020-03-04 EP disclosed
US-8377983-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2013-02-19 US disclosed
CN-102633783-A Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA INC 2012-08-15 CN disclosed
CN-101379060-B Benzoxazole-based derivatives as Aurora kinase inhibitors, compositions, and methods of use TRANSTECH PHARMA INC 2012-05-23 CN disclosed
US-7820821-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2010-10-26 US disclosed
US-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors TRANSTECH PHARMA, INC. (US) 2010-06-17 US disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed
EP-0448206-B1 Substituted benzimidazole and indazole derivatives, processes for their preparation and their use as herbicides ZENECA LTD (GB) 1994-12-28 EP disclosed
US-5306692-A Herbicidal indazole and benzimidazole compounds ZENECA LIMITED (GB) 1994-04-26 US disclosed
EP-0448206-A2 Substituted benzimidazole and indazole derivatives, processes for their preparation and their use as herbicides ZENECA LIMITED (GB) 1991-09-25 EP disclosed
CN-1054063-A Heterogeneous ring compound ICI PLC (GB) 1991-08-28 CN disclosed
US-4020111-A Propynyloxy alkyl arene insecticides HENNESSY DOUGLAS J 1977-04-26 US disclosed
US-3954793-A INSECTICIDES HENNESSY DOUGLAS J 1976-05-04 US disclosed
US-3933498-A Fogged, direct positive silver halide emulsions containing a bleach inhibiting compound and a Dmin maintainer compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-01-20 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 (3 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-20200190038-A1 METHOD FOR PRODUCING DIFLUOROMETHYLENE COMPOUND HACL2, MGLL, ABL1 MAPT 4687/4885HPGD 3753/4885DAO 167/4885
US-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors AURKC, AURKA, AURKB MAPT 1464/4885HPGD 3750/4885DAO 3918/4885
US-11084792-B2 Method for producing difluoromethylene compound HACL2, MGLL, ABL1 MAPT 4687/4885HPGD 3753/4885DAO 167/4885

“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.