SCHEMBL250079

SCHEMBL250079

O=[N+]([O-])c1cccc(CBr)c1F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
TSHR P16473 3/20 0.47
TDP1 Q9NUW8 2/20 0.45
GPR35 Q9HC97 2/20 0.44
HPGD P15428 1/20 0.43
ALDH3A1 P30838 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
S100A4 P26447 1/20 0.39
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL29842916 1.00 ALDH1A1 (0.47) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL12648507 0.83 TDP1 (0.50) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL961175 0.81 ALDH1A1 (0.52) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL17141360 0.81 ALDH1A1 (0.67) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL5237985 0.81 ALDH1A1 (0.50) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL14983803 0.81 TDP1 (0.44) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL30100131 0.80 ALDH1A1 (0.64) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL70062 0.80 ALDH1A1 (0.64) ALDH1A1TSHRTDP1HPGDHSD17B10
SCHEMBL28901826 0.80 ALDH1A1 (0.46) ALDH1A1TSHRTDP1GPR35HPGD
SCHEMBL3010961 0.80 TDP1 (0.61) ALDH1A1TSHRTDP1GPR35SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11958809-B2 Salt of omecamtiv mecarbil and process for preparing salt CYTOKINETICS, INC. (US) 2024-04-16 US claimed
EP-4305018-A2 SYNTHESIS OF OMECAMTIV MECARBIL Amgen Inc. (US) 2024-01-17 EP claimed
CN-117157274-A Synthesis of olmesartan Mo Kabi mol 安进股份有限公司 2023-12-01 CN claimed
US-20230373955-A1 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC. 2023-11-23 US claimed
US-11702380-B2 Synthesis of omecamtiv mecarbil AMGEN INC. (US) 2023-07-18 US claimed
CN-110799503-B Synthesis of Meicartine 美国安进公司 2023-06-27 CN claimed
US-20220298099-A1 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC. 2022-09-22 US claimed
WO-2022192414-A2 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC. (US) 2022-09-15 WO claimed
US-20220153700-A1 SALT OF OMECAMTIV MECARBIL AND PROCESS FOR PREPARING SALT CYTOKINETICS, INC. 2022-05-19 US claimed
US-11040956-B2 Synthesis of omecamtiv mecarbil AMGEN INC. (US) 2021-06-22 US claimed
EP-3645518-B1 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC (US) 2021-05-19 EP claimed
US-20200308143-A1 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC. 2020-10-01 US claimed
EP-3645518-A1 SYNTHESIS OF OMECAMTIV MECARBIL Amgen Inc. (US) 2020-05-06 EP claimed
CN-110799503-A Synthesis of mecamitocainide 美国安进公司 2020-02-14 CN claimed
WO-2019006231-A1 SYNTHESIS OF OMECAMTIV MECARBIL AMGEN INC. (US) 2019-01-03 WO claimed
US-12583821-B2 Salt of omecamtiv mecarbil and process for preparing salt CYTOKINETICS, INC. (US) 2026-03-24 US disclosed
EP-4698520-A1 RAF-MEK PROTEIN COMPLEX MODULATORS AND METHODS OF USE THEREOF Gandeeva Therapeutics, Inc. (US) 2026-02-25 EP disclosed
EP-1982982-A1 NOVEL COUMARIN DERIVATIVE HAVING ANTITUMOR ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-10-22 EP disclosed
EP-1761520-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2007-03-14 EP disclosed
WO-2006009741-A1 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2006-01-26 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 (8 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-20200308143-A1 SYNTHESIS OF OMECAMTIV MECARBIL SI, DPYD, MTHFD2 ALDH1A1 547/4885TSHR 4409/4885TDP1 3924/4885
US-11040956-B2 Synthesis of omecamtiv mecarbil SI, DPYD, MTHFD2 ALDH1A1 547/4885TSHR 4409/4885TDP1 3924/4885
US-11702380-B2 Synthesis of omecamtiv mecarbil SI, MTHFD2, DPYD ALDH1A1 1017/4885TSHR 4312/4885TDP1 3903/4885
US-20220153700-A1 SALT OF OMECAMTIV MECARBIL AND PROCESS FOR PREPARING SALT SI, SLC5A6, SLC28A1 ALDH1A1 1835/4885TSHR 4307/4885TDP1 3853/4885
US-20230373955-A1 SYNTHESIS OF OMECAMTIV MECARBIL DPYD, SI, MTHFD2 ALDH1A1 570/4885TSHR 4415/4885TDP1 3895/4885
US-20220298099-A1 SYNTHESIS OF OMECAMTIV MECARBIL SI, MTHFD2, DPYD ALDH1A1 1017/4885TSHR 4312/4885TDP1 3903/4885
US-12583821-B2 Salt of omecamtiv mecarbil and process for preparing salt SLC28A2, SLC28A1, SLC5A11 ALDH1A1 1521/4885TSHR 2392/4885TDP1 3475/4885
US-11958809-B2 Salt of omecamtiv mecarbil and process for preparing salt SI, SLC5A6, SLC28A1 ALDH1A1 1835/4885TSHR 4307/4885TDP1 3853/4885

“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.