SCHEMBL139113

SCHEMBL139113

Nc1cc(F)c(O)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CA3 P07451 1/20 0.40
HSD17B10 Q99714 3/20 0.37
CYP3A4 P08684 2/20 0.37
ADRB2 P07550 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ADRA1A P35348 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL938014 0.89 ALDH1A1 (0.40) CA6CA5ACA9CA14CA5B
SCHEMBL30221923 0.89 ALDH1A1 (0.40) CA6CA5ACA9CA14CA5B
SCHEMBL12021951 0.83 ALDH1A1 (0.41) CA6CA5ACA9CA14CA5B
SCHEMBL5513421 0.82 CA9 (0.53) CA6CA5ACA9CA14CA5B
SCHEMBL1099578 0.82 ALDH1A1 (0.53) CA6CA5ACA9CA14CA5B
SCHEMBL932471 0.80 ALDH1A1 (0.42) CA6CA5ACA9CA14CA5B
SCHEMBL13331358 0.77 ALDH1A1 (0.36) CA6CA5ACA9CA14CA5B
SCHEMBL16904519 0.77 CYP3A4 (0.46) CA6CA5ACA9CA14CA5B
SCHEMBL4034317 0.77 HSD17B10 (0.46) CA6CA5ACA9CA14CA5B
SCHEMBL4843454 0.77 GAA (0.50) CA6CA5ACA9CA14CA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080139795-A1 Preparation of halogenated 4-aminophenols LANXESS DEUTSCHLAND GMBH (DE) 2008-06-12 US claimed
US-7358397-B2 Preparation of halogenated 4-aminophenols LANXESS DEUTSCHLAND GMBH (DE) 2008-04-15 US claimed
US-20050143425-A1 Preparation of halogenated 4-aminophenols LANXESS DEUTSCHLAND GMBH (DE) 2005-06-30 US claimed
EP-1514865-A1 Process for the preparation of halogen containing 4-amino phenols Bayer Chemicals AG (DE) 2005-03-16 EP claimed
EP-4673447-A1 [1,3]THIAZOLO[4,5-D]-PYRIMIDIN-7-ONES AS INHIBITORS OF NOX4 Boehringer Ingelheim International GmbH (DE) 2026-01-07 EP disclosed
US-12479850-B2 Compound having Axl and c-Met kinase inhibitory activity, preparation thereof and application thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2025-11-25 US disclosed
WO-2025072673-A1 THIAZOLE DERIVATIVES AND THEIR USE AS IRE 1 INHIBITORS AL22.02.01, INC. (US) 2025-04-03 WO disclosed
US-20240327429-A1 [1,3]Thiazolo[4,5-d]-pyrimidon-7-ones as inhibitors of NOX4 BOEHRINGER INGELHEIM INT (DE) 2024-10-03 US disclosed
WO-2024180018-A1 [1,3]THIAZOLO[4,5-D]-PYRIMIDIN-7-ONES AS INHIBITORS OF NOX4 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-09-06 WO disclosed
CN-116283916-B Compound with Axl and c-Met kinase inhibition activity and preparation and application thereof 中国科学院上海药物研究所 2024-06-11 CN disclosed
CN-117486860-A Axl & c-Met dual inhibitor, preparation method and application 上海博悦生物科技有限公司 2024-02-02 CN disclosed
WO-2024022095-A1 AXL&C-MET DUAL INHIBITOR, AND PREPARATION METHOD AND USE 上海博悦生物科技有限公司 2024-02-01 WO disclosed
WO-2005117867-A2 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-15 WO disclosed
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-11-03 US disclosed
US-20050143425-A1 Preparation of halogenated 4-aminophenols LANXESS DEUTSCHLAND GMBH (DE) 2005-06-30 US disclosed
CN-1616412-A Process for the preparation of halogen containing 4-amino phenols BAYER CHEMICALS AG (DE) 2005-05-18 CN disclosed
EP-1514865-A1 Process for the preparation of halogen containing 4-amino phenols Bayer Chemicals AG (DE) 2005-03-16 EP disclosed
EP-1514865-A1 Process for the preparation of halogen containing 4-amino phenols Bayer Chemicals AG (DE) 2005-03-16 EP disclosed
US-20050038031-A1 Novel bicyclic urea derivatives useful in the treatment of cancer and other disorders BAYER HEALTHCARE LLC 2005-02-17 US disclosed
WO-2004078748-A2 NOVEL BICYCLIC UREA DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND OTHER DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2004-09-16 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 (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-20050038031-A1 Novel bicyclic urea derivatives useful in the treatment of cancer and other disorders CCNC, UACA, SLC14A1 CA6 3240/4885CA5A 1214/4885CA9 3120/4885
US-20240327429-A1 [1,3]Thiazolo[4,5-d]-pyrimidon-7-ones as inhibitors of NOX4 NOX4, NOX1, NOX5 CA6 4374/4885CA5A 487/4885CA9 4667/4885
US-20080139795-A1 Preparation of halogenated 4-aminophenols CYP4X1, CYP4B1, PAH CA6 3175/4885CA5A 3167/4885CA9 3160/4885
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors CDK2, MAP3K19, CDK1 CA6 2908/4885CA5A 2177/4885CA9 2863/4885
US-20050143425-A1 Preparation of halogenated 4-aminophenols CYP4X1, HPD, CYP4F8 CA6 3299/4885CA5A 2968/4885CA9 2664/4885
US-12479850-B2 Compound having Axl and c-Met kinase inhibitory activity, preparation thereof and application thereof MET, MERTK, AXL CA6 2909/4885CA5A 3881/4885CA9 2279/4885

“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.