SCHEMBL692253

SCHEMBL692253

Cc1ccc(Cl)cc1C=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.57
TDP1 Q9NUW8 1/20 0.56
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
CYP3A4 P08684 2/20 0.46
HPGD P15428 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPN1 P18031 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
POLB P06746 1/20 0.38
XDH P47989 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
SCHEMBL29957786 1.00 ERN1 (0.57) ERN1TDP1ALDH1A1TSHRCYP3A4
SCHEMBL269702 0.82 TDP1 (0.61) ERN1TDP1ALDH1A1TSHRCYP3A4
SCHEMBL22171539 0.81 CYP3A4 (0.50) ERN1TDP1ALDH1A1CYP3A4TP53
SCHEMBL11664145 0.79 ERN1 (0.41) ERN1TDP1ALDH1A1TSHRCYP3A4
SCHEMBL11664142 0.79 ERN1 (0.41) ERN1TDP1ALDH1A1TSHRCYP3A4
SCHEMBL28030980 0.79 CYP3A4 (0.48) ERN1TDP1ALDH1A1TSHRCYP3A4
SCHEMBL4357334 0.78 TDP1 (0.70) ERN1TDP1ALDH1A1HPGDTP53
SCHEMBL2559192 0.78 RAPGEF4 (0.51) ERN1TDP1ALDH1A1TSHRLMNA
SCHEMBL7820969 0.77 CYP3A4 (0.46) ERN1TDP1ALDH1A1CYP3A4TP53
SCHEMBL6258762 0.77 CYP3A4 (0.46) ERN1TDP1ALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113831253-B Pendimethalin hapten as well as preparation method and application thereof 南京农业大学 2023-07-04 CN claimed
CN-113831253-A Pendimethalin hapten as well as preparation method and application thereof 南京农业大学 2021-12-24 CN claimed
CN-111253223-A Triarylmethane derivatives with large steric hindrance and synthesis method thereof 重庆医科大学 2020-06-09 CN claimed
CN-1029680-C Process for synthesizing benzfluorenol as antimalarial INST OF MICROBIOLOGY & EPIDEMI (CN) 1995-09-06 CN claimed
EP-4605409-A2 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2025-08-27 EP disclosed
WO-2025059417-A1 INHIBITING HUMAN INTEGRIN α4β7 MORPHIC THERAPEUTIC, INC. (US) 2025-03-20 WO disclosed
US-20240218021-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-07-04 US disclosed
WO-2024086814-A2 CYCLIN INHIBITORS CIRCLE PHARMA, INC. (US) 2024-04-25 WO disclosed
CN-113979835-B Synthesis method of pazopanib trimer impurity intermediate 重庆医科大学 2023-09-26 CN disclosed
CN-113979835-B Synthesis method of pazopanib trimer impurity intermediate 重庆医科大学 2023-09-26 CN disclosed
CN-113831253-B Pendimethalin hapten as well as preparation method and application thereof 南京农业大学 2023-07-04 CN disclosed
US-20230167089-A1 ORGANIC MATERIAL COMPOSITION AND APPLICATIONS THEREOF NINGBO LUMILAN ADVANCED MATERIALS CO., LTD. (CN) 2023-06-01 US disclosed
US-6350749-B1 SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-26 US disclosed
US-6242493-B1 PROSTAGLANDIN INHIBITORS; ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS MERCK FROSST CANADA & CO. (CA) 2001-06-05 US disclosed
CN-1290249-A Aminoguanidine hydrazone derivatives, process for producing the same and drugs thereof TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-04-04 CN disclosed
EP-1071648-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT Merck Frosst Canada & Co. (CA) 2001-01-31 EP disclosed
EP-1057812-A1 AMINOGUANIDINE HYDRAZONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-12-06 EP disclosed
EP-0950418-A2 Composition for preventing or treating ischemic disease Takeda Chemical Industries, Ltd. (JP) 1999-10-20 EP disclosed
WO-1999047497-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK FROSST CANADA & CO. (CA) 1999-09-23 WO disclosed
US-4112095-A 6-Phenyl-1,2,4-triazolo[4,3-b]pyridazine hypotensive agents AMERICAN CYANAMID COMPANY (US) 1978-09-05 US 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 (2 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-20230167089-A1 ORGANIC MATERIAL COMPOSITION AND APPLICATIONS THEREOF PIEZO1, VCL, VDAC3 ERN1 2498/4885TDP1 1585/4885ALDH1A1 2385/4885
US-20240218021-A1 CYCLIN INHIBITORS CCNI, CCNC, CDK2 ERN1 874/4885TDP1 1596/4885ALDH1A1 2597/4885

“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.