SCHEMBL330502

SCHEMBL330502

Nc1cc(C(F)(F)F)ccc1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 3/20 0.52
PKM P14618 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CES2 O00748 2/20 0.50
L3MBTL1 Q9Y468 4/20 0.47
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.47
MEN1 O00255 1/20 0.47
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
CFTR P13569 1/20 0.46
LMNA P02545 2/20 0.44
RAB9A P51151 1/20 0.44
NOS3 P29474 1/20 0.43
NOS2 P35228 1/20 0.43
KIF11 P52732 3/20 0.43

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
SCHEMBL8172805 0.85 ALDH1A1 (0.39) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL6671502 0.85 ESR1 (0.40) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL8480050 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL24852666 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL185847 0.81 CES2 (0.50) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL161784 0.80 ALDH1A1 (0.55) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL29505675 0.80 ALDH1A1 (0.55) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL16467229 0.79 POLQ (0.48) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL3657472 0.79 POLQ (0.48) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL24852672 0.78 ALDH1A1 (0.46) ALDH1A1KDM4EPKMHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930593-A Near infrared fluorescent probe for detecting cyclic hypoxia and preparation method and application thereof 南通大学 2025-05-06 CN claimed
CN-119661626-A Synthesis method of dutasteride impurity 湖南科瑞生物制药股份有限公司 2025-03-21 CN claimed
CN-114113363-B Method for detecting impurities in dutasteride soft capsules 人福普克药业(武汉)有限公司 2024-06-11 CN claimed
CN-117466967-A Preparation method of dutasteride 湖南玉新药业有限公司 2024-01-30 CN claimed
CN-110950923-B Method for recovering dutasteride from dutasteride mother liquor 湖北葛店人福药业有限责任公司 2022-12-23 CN claimed
CN-114113363-A Method for detecting impurities in dutasteride soft capsules 人福普克药业(武汉)有限公司 2022-03-01 CN claimed
CN-109490444-B Method for separating and measuring degradation impurities in dutasteride raw material medicine and preparation by HPLC (high performance liquid chromatography) method 重庆华邦制药有限公司 2021-06-01 CN claimed
CN-110845310-A Method for iodinating ortho-position of benzaldehyde compound 平顶山学院 2020-02-28 CN claimed
EP-2238152-B1 PROCESSES FOR PREPARATION OF DUTASTERIDE GADOR SA (AR) 2015-02-18 EP claimed
EP-2414378-B1 SEPARATION OF 4-AZA-ANDROST-1-ENE-17-OIC ACID FROM 4-AZA-ANDROSTAN-17-OIC ACID PHF SA (CH) 2014-03-05 EP claimed
US-20090203724-A1 SOLID AND CRYSTALLINE DUTASTERIDE AND PROCESSES FOR PREPARATION THEREOF GADOR S.A. (AR) 2009-08-13 US claimed
WO-2009083258-A2 SOLID AND CRYSTALLINE DUTASTERIDE AND PROCESSES FOR PREPARATION THEREOF GADOR S.A. (AR) 2009-07-09 WO claimed
EP-1468983-B1 PROCESS FOR PRODUCING 2,5-BIS(TRIFLUOROMETHYL)NITROBENZENE ASAHI GLASS CO LTD (JP) 2007-11-21 EP claimed
US-7038050-B2 Method for the preparation of highly pure 1-androstene derivatives HANMI PHARM. CO., LTD. (KR) 2006-05-02 US claimed
EP-1646640-A1 METHOD FOR THE PREPARATION OF HIGHLY PURE 1-ANDROSTENE DERIVATIVES Hanmi Pharm. Co., Ltd. (KR) 2006-04-19 EP claimed
US-20050245744-A1 Method for the preparation of highly pure 1-androstene derivatives HANMI PHARM. CO., LTLD. (KR) 2005-11-03 US claimed
US-6930214-B2 Process for producing 2,5-bis(trifluoromethyl)nitrobenzene ASAHI GLASS COMPANY, LIMITED (JP) 2005-08-16 US claimed
WO-2005007670-A1 METHOD FOR THE PREPARATION OF HIGHLY PURE 1-ANDROSTENE DERIVATIVES HANMI PHARM. CO., LTD. (KR) 2005-01-27 WO claimed
US-20040242942-A1 Process for producing 2,5-bis(trifluoromethyl)nitrobenzene ASAHI GLASS COMPANY LIMITED (JP) 2004-12-02 US claimed
EP-1468983-A1 PROCESS FOR PRODUCING 2,5-BIS(TRIFLUOROMETHYL)NITROBENZENE ASAHI GLASS COMPANY LTD. (JP) 2004-10-20 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20050245744-A1 Method for the preparation of highly pure 1-androstene derivatives CYP19A1, HSD17B11, CYP17A1 ALDH1A1 252/4885KDM4E 4514/4885PKM 3627/4885
US-20090203724-A1 SOLID AND CRYSTALLINE DUTASTERIDE AND PROCESSES FOR PREPARATION THEREOF AR, CYP21A2, CYP4A22 ALDH1A1 1010/4885KDM4E 286/4885PKM 4184/4885
US-20040242942-A1 Process for producing 2,5-bis(trifluoromethyl)nitrobenzene NOS2, NOS1, NOX5 ALDH1A1 1871/4885KDM4E 2896/4885PKM 2230/4885

“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.