SCHEMBL14744347

SCHEMBL14744347

N#Cc1cc([N+](=O)[O-])cc(F)c1Br

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 3/20 0.52
XDH P47989 1/20 0.49
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.42
CYP19A1 P11511 1/20 0.41
GAA P10253 4/20 0.38
HTT P42858 1/20 0.38
HIF1A Q16665 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
CYP3A4 P08684 1/20 0.36
GPR35 Q9HC97 1/20 0.35
TSHR P16473 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL505035 0.82 VCAM1 (0.55) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL29310309 0.81 CYP19A1 (0.48) VCAM1ALDH1A1LMNACYP19A1HTT
SCHEMBL20299265 0.79 VCAM1 (0.52) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL30202647 0.79 VCAM1 (0.52) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL14744515 0.79 VCAM1 (0.60) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL658767 0.79 VCAM1 (0.52) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL18339775 0.79 VCAM1 (0.47) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL7782406 0.76 VCAM1 (0.55) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL26926562 0.76 VCAM1 (0.47) VCAM1XDHALDH1A1LMNACYP19A1
SCHEMBL361867 0.75 VCAM1 (0.59) VCAM1XDHALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353835-A1 N-TETRAZOLYL ARYL UREA-BASED DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF HANGZHOU YIRUI PHARMACEUTICAL TECHNOLOGY CO., LTD (CN) 2025-11-20 US disclosed
EP-4538261-A1 N-TETRAZOLYL ARYL UREA DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF Hangzhou Yirui Pharmaceutical Technology Co., Ltd. (CN) 2025-04-16 EP disclosed
CN-117229258-B N-tetrazolyl aryl urea derivative and preparation method and application thereof 杭州壹瑞医药科技有限公司 2024-07-19 CN disclosed
CN-117229258-A N-tetrazolyl aryl urea derivative and preparation method and application thereof 杭州壹瑞医药科技有限公司 2023-12-15 CN disclosed
WO-2023237015-A1 N-TETRAZOLYL ARYL UREA DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF 杭州壹瑞医药科技有限公司 2023-12-14 WO disclosed
CN-117209472-A KIF18A inhibitors 武汉人福创新药物研发中心有限公司 2023-12-12 CN disclosed
US-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 US disclosed
US-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 US disclosed
EP-3558972-A1 TETRAZOLE CONTAINING COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2019-10-30 EP disclosed
US-20190194148-A1 TETRAZOLE-CONTAINING 1,2-CYCLOPROPANE-CARBOXAMIDES Bayer Pharma AG (DE) 2019-06-27 US disclosed
US-20190194148-A1 TETRAZOLE-CONTAINING 1,2-CYCLOPROPANE-CARBOXAMIDES Bayer Pharma AG (DE) 2019-06-27 US disclosed
US-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES Bayer Pharma AG (DE) 2019-06-13 US disclosed
US-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES Bayer Pharma AG (DE) 2019-06-13 US disclosed
WO-2018114783-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-28 WO disclosed
WO-2013029338-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-03-07 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 (4 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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS TSLP, IL5, TRPA1 VCAM1 1377/4885XDH 808/4885ALDH1A1 485/4885
US-20190177284-A1 TETRAZOLYL-CONTAINING CYCLOPROPANECARBOXAMIDES GAP43, PSEN1, PSEN2 VCAM1 3998/4885XDH 1234/4885ALDH1A1 1165/4885
US-20190194148-A1 TETRAZOLE-CONTAINING 1,2-CYCLOPROPANE-CARBOXAMIDES HNMT, AANAT, CHRNA5 VCAM1 3900/4885XDH 1162/4885ALDH1A1 440/4885
US-20250353835-A1 N-TETRAZOLYL ARYL UREA-BASED DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF BDKRB1, BDKRB2, UTS2R VCAM1 187/4885XDH 2018/4885ALDH1A1 2190/4885

“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.