SCHEMBL2707255

SCHEMBL2707255

CC(C)Nc1ccc(Br)cc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 3/20 0.61
MAPT P10636 3/20 0.53
MAPK1 P28482 3/20 0.53
POLB P06746 1/20 0.50
ABCB1 P08183 1/20 0.48
ABCC1 P33527 1/20 0.48
PKM P14618 1/20 0.48
RAB9A P51151 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RXFP1 Q9HBX9 1/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL990017 0.87 MAPT (0.58) HCAR3MAPTMAPK1POLBABCB1
SCHEMBL29729424 0.87 MAPT (0.58) HCAR3MAPTMAPK1POLBABCB1
SCHEMBL16721694 0.83 HCAR3 (0.54) HCAR3MAPTMAPK1ABCB1ABCC1
SCHEMBL16721691 0.83 HCAR3 (0.54) HCAR3MAPTMAPK1ABCB1ABCC1
SCHEMBL14764647 0.83 ALDH1A1 (0.67) HCAR3MAPTMAPK1ABCB1ABCC1
SCHEMBL7352966 0.82 HCAR3 (0.47) HCAR3MAPTMAPK1ABCB1ABCC1
SCHEMBL10249208 0.81 HCAR3 (0.63) HCAR3MAPTPOLBRAB9ACYP1A2
SCHEMBL10089736 0.81 CRHBP (0.68) HCAR3MAPTMAPK1POLBCYP1A2
SCHEMBL339294 0.81 HCAR3 (0.58) HCAR3MAPTMAPK1ABCB1ABCC1
SCHEMBL7369772 0.80 HCAR3 (0.61) HCAR3MAPTMAPK1POLBPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12492188-B2 1H-benzo[D]imidazole derivatives as TLR9 inhibitors for the treatment of fibrosis BRISTOL-MYERS SQUIBB COMPANY (US) 2025-12-09 US disclosed
CN-114585360-B Methods of using the same for treating epilepsy 特维娜有限公司 2025-04-29 CN disclosed
EP-4200292-B1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2024-11-13 EP disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-09-21 US disclosed
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-09-21 US disclosed
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-09-21 US disclosed
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 US disclosed
US-9125901-B2 4-(benzimidazol-2-ylamino)benzamide derivatives and salts or solvates thereof THE TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2015-09-08 US disclosed
WO-2015042397-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2015-03-26 WO disclosed
CN-104219954-A Benzamide derivatives TRANSLATIONAL GENOMICS RES INST 2014-12-17 CN disclosed
EP-2445345-B1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RES INST (US) 2014-08-27 EP disclosed
CN-103298788-A Pyridine derivative and medicinal agent NIPPON SHINYAKU CO LTD 2013-09-11 CN disclosed
US-8314131-B2 Triazole fused heteroaryl compounds and methods of use thereof AMGEN INC. (US) 2012-11-20 US disclosed
US-20120142922-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2012-06-07 US disclosed
EP-2445345-A1 BENZAMIDE DERIVATIVES The Translational Genomics Research Institute (US) 2012-05-02 EP disclosed
WO-2010151441-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL GENOMICS RESEARCH INSTITUTE (US) 2010-12-29 WO disclosed
US-20100292234-A1 TRIAZOLE FUSED HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF AMGEN INC. (US) 2010-11-18 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 (6 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-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME S1PR1, S1PR2, S1PR3 HCAR3 291/4885MAPT 3799/4885MAPK1 1168/4885
US-20100292234-A1 TRIAZOLE FUSED HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF MAPK1, MAPK3, CNKSR1 HCAR3 128/4885MAPT 1469/4885MAPK1 1/4885
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 HCAR3 2625/4885MAPT 4616/4885MAPK1 263/4885
US-12492188-B2 1H-benzo[D]imidazole derivatives as TLR9 inhibitors for the treatment of fibrosis TLR9, TLR1, TLR7 HCAR3 2625/4885MAPT 4616/4885MAPK1 263/4885
US-20120142922-A1 BENZAMIDE DERIVATIVES BRDT, BRD3, BRD2 HCAR3 3437/4885MAPT 4124/4885MAPK1 4506/4885
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same S1PR1, S1PR2, S1PR3 HCAR3 291/4885MAPT 3799/4885MAPK1 1168/4885

“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.