SCHEMBL648420

SCHEMBL648420

C=CCc1ccc(Br)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CYP3A4 P08684 3/20 0.52
TP53 P04637 1/20 0.52
ALOX15 P16050 1/20 0.52
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PYCR1 P32322 1/20 0.50
XDH P47989 1/20 0.46
MAPT P10636 3/20 0.45
PPARG P37231 2/20 0.45
PPARD Q03181 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH2 P05091 1/20 0.45
GAA P10253 1/20 0.45
GABRA1 P14867 1/20 0.45
AKR1B1 P15121 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL10561330 0.93 TAAR1 (0.48) ALDH1A1CYP3A4TP53ALOX15TSHR
SCHEMBL9555434 0.93 ALDH1A1 (0.47) ALDH1A1CYP3A4TP53ALOX15TSHR
SCHEMBL4614917 0.87 MEN1 (0.44) ALDH1A1CYP3A4TP53ALOX15TSHR
SCHEMBL173301 0.86 ALDH1A1 (0.64) ALDH1A1CYP3A4TP53ALOX15TSHR
Water SCHEMBL29179560 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TP53ALOX15TSHR
Phosphine SCHEMBL28908227 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TP53ALOX15TSHR
Bromide SCHEMBL8645583 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TP53ALOX15TSHR
Hydrogen Peroxide SCHEMBL5496256 0.80 ALDH1A1 (0.58) ALDH1A1CYP3A4TP53ALOX15TSHR
Hydrogen Peroxide SCHEMBL7816450 0.80 ALDH1A1 (0.58) ALDH1A1CYP3A4TP53ALOX15TSHR
SCHEMBL11815540 0.80 KMT2A (0.42) ALDH1A1CYP3A4TP53ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12589111-B2 Pt(IV) chemotherapeutic prodrug and controlled release thereof for treatment of tumors PEKING UNIVERSITY (CN) 2026-03-31 US claimed
CN-118879386-B Emulsified oil for hydraulic support and preparation method thereof 圣保路石油化工(天津)股份有限公司 2024-12-24 CN claimed
CN-118879386-A Emulsified oil for hydraulic support and preparation method thereof 圣保路石油化工(天津)股份有限公司 2024-11-01 CN claimed
CN-117416107-B Low-expansion high-flame-retardance PPO resin copper-clad plate and processing technology thereof 江苏耀鸿电子有限公司 2024-03-19 CN claimed
CN-117416107-A Low-expansion high-flame-retardance PPO resin copper-clad plate and processing technology thereof 江苏耀鸿电子有限公司 2024-01-19 CN claimed
CN-117229301-A Spirofluorene functionalized near infrared two-region fluorescent dye, synthesis method and application 南京信息工程大学 2023-12-15 CN claimed
CN-116635396-A Pt (IV) chemotherapeutic prodrugs and their controlled release for treating tumors 北京大学 2023-08-22 CN claimed
CN-115999611-A Magnesium-nitrogen co-doped titanium dioxide supported palladium-indium bimetallic catalyst and preparation method and application thereof 浙江工业大学 2023-04-25 CN claimed
CN-113121854-A Antibacterial deodorizing tablet prepared from bio-based material and application thereof 黄丹耒 2021-07-16 CN claimed
CN-111019467-A Preparation method of wear-resistant coating for breaker shell 安徽宇腾真空电气有限责任公司 2020-04-17 CN claimed
CN-105481639-A Method for preparing biphenyl compound FUYANG XINYIHUA MAT TECH CO LTD 2016-04-13 CN claimed
US-20160071740-A1 PATTERN FORMING METHOD KABUSHIKI KAISHA TOSHIBA (JP) 2016-03-10 US claimed
EP-0314778-B1 SUBSTITUTED AROMATIC SILANE COMPOUNDS AND METHOD FOR PREPARATION OF SAME Hughes Aircraft Company (US) 1991-06-19 EP claimed
US-4914247-A HALOGENATION IN PRESENCE OF ZEOLITE TYPE L CATALYST TOYO SODA MANUFACTURING CO., LTD. (JP) 1990-04-03 US claimed
US-4861901-A Substituted aromatic silane compounds and method for preparation of same HUGHES AIRCRAFT COMPANY (US) 1989-08-29 US claimed
EP-0314778-A1 SUBSTITUTED AROMATIC SILANE COMPOUNDS AND METHOD FOR PREPARATION OF SAME. HUGHES AIRCRAFT CO (US) 1989-05-10 EP claimed
US-4788268-A Method for preparation of epoxysilicone compounds and allyl-terminated silicone compounds HUGHES AIRCRAFT COMPANY (US) 1988-11-29 US claimed
WO-1988008846-A1 SUBSTITUTED AROMATIC SILANE COMPOUNDS AND METHOD FOR PREPARATION OF SAME HUGHES AIRCRAFT COMPANY (US) 1988-11-17 WO claimed
EP-0052854-B1 POLYPHENYLENE OXIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-07-02 EP claimed
EP-0052854-A1 Polyphenylene oxide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-02 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 (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-12589111-B2 Pt(IV) chemotherapeutic prodrug and controlled release thereof for treatment of tumors PTGER4, PTGDR, PTGER3 ALDH1A1 3933/4885CYP3A4 1148/4885TP53 956/4885

“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.