SCHEMBL19783654

SCHEMBL19783654

COc1c([N+](=O)[O-])ccc(Cl)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.52
MAPK1 P28482 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
RAF1 P04049 1/20 0.42
HPGD P15428 1/20 0.42
GFER P55789 1/20 0.42
PAX8 Q06710 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
MERTK Q12866 1/20 0.40
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
POLB P06746 1/20 0.39
VCAM1 P19320 5/20 0.39
ATM Q13315 1/20 0.38

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
SCHEMBL29091577 0.86 TDP1 (0.47) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL9799821 0.84 TDP1 (0.62) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL13721530 0.84 TDP1 (0.57) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL31150399 0.82 TDP1 (0.44) TDP1ALDH1A1KMT2ATSHRVCAM1
SCHEMBL521184 0.82 TDP1 (0.44) TDP1ALDH1A1KMT2ATSHRVCAM1
SCHEMBL6576154 0.81 TDP1 (0.53) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL15722112 0.81 TDP1 (0.42) TDP1ALDH1A1LMNAKMT2AMEN1
SCHEMBL2549695 0.81 ALDH1A1 (0.50) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL19181006 0.79 TDP1 (0.47) TDP1MAPK1ALDH1A1MAPTLMNA
SCHEMBL1675914 0.79 ALDH1A1 (0.41) TDP1MAPK1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260070871-A1 PROCESS FOR PREPARATION OF 2-CHLORO-3-FLUORO-4-ALKOXY-ANILINES AND 2-FLUORO-3-CHLOROPHENOL BAYER AG (DE) 2026-03-12 US disclosed
CN-119451936-A Process for preparing 2-chloro-3-fluoro-4-alkoxy-aniline and 2-fluoro-3-chlorophenol 拜耳公司 2025-02-14 CN disclosed
US-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
CN-112142567-B Preparation method of 2-fluoro-3-chlorophenol 浙江永太科技股份有限公司 2023-11-14 CN disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
CN-112142567-A Preparation method of 2-fluoro-3-chlorophenol 浙江永太科技股份有限公司 2020-12-29 CN disclosed
EP-3484878-B1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-08-19 EP disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 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-20260070871-A1 PROCESS FOR PREPARATION OF 2-CHLORO-3-FLUORO-4-ALKOXY-ANILINES AND 2-FLUORO-3-CHLOROPHENOL CYP2E1, CYP1A1, CYP2F1 TDP1 1312/4885MAPK1 256/4885ALDH1A1 92/4885
US-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 TDP1 227/4885MAPK1 2622/4885ALDH1A1 1598/4885
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, PF4 TDP1 353/4885MAPK1 3368/4885ALDH1A1 1618/4885
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, F12 TDP1 227/4885MAPK1 2622/4885ALDH1A1 1598/4885

“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.