SCHEMBL2235308

SCHEMBL2235308

O=C1OC(Cl)(Cl)c2c1ccc(Cl)c2Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.39
TYMS P04818 2/20 0.38
MAPT P10636 2/20 0.33
GALR3 O60755 1/20 0.33
NOTUM Q6P988 1/20 0.33
PKM P14618 1/20 0.33
PDE7A Q13946 1/20 0.33
TSHR P16473 2/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
ERCC1 P07992 1/20 0.32
ALOX12 P18054 1/20 0.32
FEN1 P39748 1/20 0.32
ERCC4 Q92889 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
NSD2 O96028 1/20 0.32
BCHE P06276 1/20 0.32

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
SCHEMBL5139378 0.80 NSD2 (0.41) CES1TYMSMAPTNOTUMKDM4E
SCHEMBL11860355 0.77 CES1 (0.32) CES1AHR
SCHEMBL9506050 0.72 CES1 (0.37) CES1TYMS
SCHEMBL9502953 0.69 CES1 (0.39) CES1TYMSDHFR
SCHEMBL5311928 0.68 CES1 (0.46) CES1TYMSMAPTPKMPDE7A
SCHEMBL9506738 0.65 PPOX (0.42) CES1TYMSMAPTTSHRPOLB
SCHEMBL9503899 0.64 CES1 (0.35) CES1TYMSTDP1ALDH1A1HPGD
SCHEMBL29963323 0.63 CFTR (0.53) TYMSMAPTPKMTSHRCYP1A2
SCHEMBL2892505 0.63 CFTR (0.53) TYMSMAPTPKMTSHRCYP1A2
SCHEMBL8649408 0.63 ALDH1A1 (0.42) TSHRTDP1ALDH1A1HPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570901-A1 METHOD FOR SELECTIVE REMOVAL OF UNDIFFERENTIATED PLURIPOTENT STEM CELLS Buddhist Tzu Chi Medical Foundation (TW) 2025-06-18 EP claimed
CN-120137900-A Method for selectively removing undifferentiated pluripotent stem cells 佛教慈济医疗财团法人 2025-06-13 CN claimed
US-20250188411-A1 METHOD FOR SELECTIVE REMOVAL OF UNDIFFERENTIATED PLURIPOTENT STEM CELLS BUDDHIST TZU CHI MEDICAL FOUNDATION (TW) 2025-06-12 US claimed
CN-119744863-A Bactericide composition and application thereof 江苏中旗科技股份有限公司 2025-04-04 CN claimed
CN-118284335-A Pesticide composition, information processing device, and computer program 日商拜耳作物科学股份有限公司 2024-07-02 CN claimed
CN-118140927-A Sterilization insecticidal composition containing quinolone compounds and application thereof 潍坊中农联合化工有限公司 2024-06-07 CN claimed
US-20240138408-A1 COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF SHANGDONG KANGIAO BIO-TECHNOLOGY CO., LTD (CN) 2024-05-02 US claimed
CN-116333019-B Fluorocytidine compound and preparation method and application thereof 沈阳农业大学 2024-04-02 CN claimed
WO-2024046311-A1 COMPOSITION USED FOR KILLING FUNGI AND METHOD FOR APPLYING COMPOSITION 江苏中旗科技股份有限公司 2024-03-07 WO claimed
CN-117396074-A Fungicidal compositions containing oxadiazole compounds PI工业有限公司 2024-01-12 CN claimed
CN-102633745-A Alpha-methoxy imino group-4-methyl-1, 2, 3-thiadiazole-5-methyl carboxylic ester derivatives and preparation method and application thereof UNIV NANKAI 2012-08-15 CN claimed
CN-102633747-A 5-methyl-1, 2, 3-thiadiazole bishydrazide derivatives as well as preparation method and application thereof UNIV NANKAI 2012-08-15 CN claimed
CN-102633746-A Di-hydrazide derivatives containing 5-methyl-1, 2, 3-thiadizole and preparation method and application of di-hydrazide derivatives containing 5-methyl-1, 2, 3-thiadizole UNIV NANKAI 2012-08-15 CN claimed
CN-102603669-A Derivatives of alpha-methoxyl imino-5-methyl-1,2,3-thiadiazole-4- carboxylic acid methyl ester and preparation methods and uses thereof UNIV NANKAI 2012-07-25 CN claimed
CN-102603670-A 4-(4-methyl-1,2,3-thiadiazole-5-base)-3-alkene-2-ketone ramifications, and preparation method and application thereof UNIV NANKAI 2012-07-25 CN claimed
CN-101863856-A Bi(4-methyl-1,2,3-thiadiazole-5-phenurone) compounds and preparation method and application thereof LIER CHEMICAL CO LTD 2010-10-20 CN claimed
CN-101199274-A Bactericide composition and method for controlling plant disease ISHIHARA SANGYO KAISHA (JP) 2008-06-18 CN claimed
EP-0325231-B1 Heat-sensitive recording material JUJO PAPER CO LTD (JP) 1994-06-22 EP claimed
EP-0242170-B1 DIVINYL COMPOUNDS AND CHROMOGENIC RECORDING-MATERIAL PREPARED BY USE THEREOF YAMADA CHEMICAL CO., LTD. (JP) 1991-09-18 EP claimed
US-4699872-A PHOTODISSOCIABLE CHOLINE CHLORIDE, IMAGE FORMING COMPOUNDS, POLYMERIC BINDER, LOW MELTING WAX SCULLY, RICHARD L. 1987-10-13 US 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 (1 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-20240138408-A1 COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF BCHE, AAAS, BROX CES1 968/4885TYMS 2861/4885MAPT 941/4885

“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.