SCHEMBL980376

SCHEMBL980376

O=C(O)c1ccc(I)cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
CA12 O43570 3/20 0.61
CA1 P00915 3/20 0.61
CA2 P00918 3/20 0.61
CA7 P43166 3/20 0.61
CA9 Q16790 3/20 0.61
CA14 Q9ULX7 3/20 0.61
TSHR P16473 1/20 0.61
KDM4E B2RXH2 5/20 0.57
PTPN1 P18031 3/20 0.57
MAPT P10636 2/20 0.57
CYP3A4 P08684 1/20 0.57
GAA P10253 1/20 0.57
ESR2 Q92731 1/20 0.57
HNF4A P41235 1/20 0.53
ACMSD Q8TDX5 1/20 0.53
HPGD P15428 4/20 0.48
HSD17B10 Q99714 3/20 0.48
GRM1 Q13255 2/20 0.48
GRM2 Q14416 2/20 0.48

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
Acetamide SCHEMBL7251208 0.90 ALDH1A1 (0.53) ALDH1A1CA12CA1CA2CA7
SCHEMBL28789444 0.83 ALDH1A1 (0.58) ALDH1A1CA12CA1CA2CA7
SCHEMBL129664 0.82 CA1 (0.61) ALDH1A1CA12CA1CA2CA7
SCHEMBL29662013 0.82 CA1 (0.61) ALDH1A1CA12CA1CA2CA7
SCHEMBL522679 0.81 PTPN1 (0.55) ALDH1A1CA12CA1CA2CA7
SCHEMBL15270445 0.80 CES2 (0.45) ALDH1A1CA12CA1CA2CA7
SCHEMBL11458189 0.80 ERN1 (0.41) ALDH1A1CA12CA1CA2CA7
SCHEMBL3341120 0.80 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL31396647 0.80 ALDH1A1 (0.50) ALDH1A1CA12CA1CA2CA7
SCHEMBL24407738 0.79 ALDH1A1 (0.48) ALDH1A1CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751377-A Synthesis method of 2- (benzothiazole-2-yl) -5- (hex-1-yne-1-yl) phenol 南京恒贝新材料有限公司 2025-04-04 CN claimed
CN-112079712-B Preparation method of p-vinyl salicylic acid 江苏美迪克化学品有限公司 2022-12-13 CN claimed
CN-112079712-A Preparation method of p-vinyl salicylic acid 江苏美迪克化学品有限公司 2020-12-15 CN claimed
CN-104070307-B Solder flux composition and solder composition 株式会社田村制作所 2018-02-23 CN claimed
US-20250289780-A1 N,N'-DIPHENYL-4,4'-BIPHENYLDICARBOXAMIDE ANALOGS AND THEIR USE IN CANCER TREATMENT BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2025-09-18 US disclosed
US-20250214920-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND KAO CORPORATION (JP) 2025-07-03 US disclosed
WO-2025124618-A1 DESIGN, PREPARATION AND APPLICATION OF TARGETED ACTIVATION ENRICHMENT TYPE NEAR-INFRARED PROBE AND PHOTOSENSITIZER 华东理工大学 2025-06-19 WO disclosed
CN-120136922-A Design, preparation and application of targeted activation enrichment near infrared probe and photosensitizer 华东理工大学 2025-06-13 CN disclosed
CN-119751377-A Synthesis method of 2- (benzothiazole-2-yl) -5- (hex-1-yne-1-yl) phenol 南京恒贝新材料有限公司 2025-04-04 CN disclosed
CN-119751377-A Synthesis method of 2- (benzothiazole-2-yl) -5- (hex-1-yne-1-yl) phenol 南京恒贝新材料有限公司 2025-04-04 CN disclosed
US-20250041408-A1 SMALL MOLECULE IMMUNOPOTENTIATOR CONJUGATES OF NFKB ACTIVATORS AS ADJUVANTS WITH ENHANCED EFFICACY AND REDUCED TOXICITY THE UNIVERSITY OF CHICAGO 2025-02-06 US disclosed
EP-4501896-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND Kao Corporation (JP) 2025-02-05 EP disclosed
WO-1995013262-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1995-05-18 WO disclosed
US-5358948-A Psychological, nervous system disorders GLAXCO GROUP LIMITED (GB) 1994-10-25 US disclosed
US-5244771-A Bridged indicator dyes used as light-absorbing, pH-sensitive optical filter agents in diffusion transfer POLAROID CORPORATION (US) 1993-09-14 US disclosed
EP-0553346-A1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORPORATION (US) 1993-08-04 EP disclosed
CN-1073430-A Benzanilide derivatives GLAXO GROUP LTD (GB) 1993-06-23 CN disclosed
WO-1993006084-A1 BENZANILIDE DERIVATIVES AS 5-HT1D ANTAGONISTS GLAXO GROUP LIMITED (GB) 1993-04-01 WO disclosed
EP-0533267-A1 Benzanilide derivatives as 5-HT1D antagonists GLAXO GROUP LIMITED (GB) 1993-03-24 EP disclosed
WO-1993004403-A1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORPORATION (US) 1993-03-04 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 (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-20250214920-A1 METHOD FOR PRODUCING CYCLIC DIKETONE COMPOUND CYP4F2, DUOX1, BCKDK ALDH1A1 973/4885CA12 1156/4885CA1 1048/4885
US-20250289780-A1 N,N'-DIPHENYL-4,4'-BIPHENYLDICARBOXAMIDE ANALOGS AND THEIR USE IN CANCER TREATMENT NCOR1, NR1H4, NR1I2 ALDH1A1 2644/4885CA12 2884/4885CA1 2457/4885
US-20250041408-A1 SMALL MOLECULE IMMUNOPOTENTIATOR CONJUGATES OF NFKB ACTIVATORS AS ADJUVANTS WITH ENHANCED EFFICACY AND REDUCED TOXICITY NFKBIA, NFRKB, NFKB2 ALDH1A1 4393/4885CA12 3791/4885CA1 4344/4885

“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.