SCHEMBL1556590

SCHEMBL1556590

O=C(Cl)/C=C/c1cccc(Cl)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.76
CYP2C9 P11712 2/20 0.76
MAOB P27338 6/20 0.65
MAOA P21397 3/20 0.58
CYP2D6 P10635 2/20 0.58
CYP1A1 P04798 2/20 0.58
CYP1B1 Q16678 2/20 0.58
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
LMNA P02545 1/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C19 P33261 2/20 0.55
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
FBP1 P09467 1/20 0.51
MMP1 P03956 2/20 0.51
MMP2 P08253 2/20 0.51

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
SCHEMBL1556592 1.00 CYP1A2 (0.76) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL10981903 0.88 CYP1A2 (0.57) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL7927174 0.88 CYP1A2 (0.57) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL5598566 0.86 CYP1A2 (1.00) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL22596713 0.86 CYP1A2 (0.79) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL5598564 0.86 CYP1A2 (1.00) CYP1A2CYP2C9MAOBMAOACYP2D6
SCHEMBL31553466 0.86 CYP1A2 (1.00) CYP1A2CYP2C9MAOBMAOACYP2D6
3-Chloro-Cinnamic Acid SCHEMBL79592 0.85 CYP1A2 (0.76) CYP1A2CYP2C9MAOBMAOACYP2D6
3-Chloro-Cinnamic Acid SCHEMBL79591 0.85 CYP1A2 (0.76) CYP1A2CYP2C9MAOBMAOACYP2D6
3-Chloro-Cinnamic Acid SCHEMBL22396853 0.85 CYP1A2 (0.76) CYP1A2CYP2C9MAOBMAOACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120118144-A Ursolic acid derivative, preparation method thereof and application thereof in glioma resistance 中国医学科学院药物研究所 2025-06-10 CN disclosed
CN-114230519-B Pleuromutilin cinnamate compounds with drug-resistant bacteria resisting activity, and synthetic method and application thereof 西咸新区沣厚原创医药科技有限公司 2024-06-04 CN disclosed
US-11872202-B2 Pleuromutilin cinnamic acid ester compounds with activities against antibiotic-resistant infections SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2024-01-16 US disclosed
US-11872202-B2 Pleuromutilin cinnamic acid ester compounds with activities against antibiotic-resistant infections SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2024-01-16 US disclosed
US-20230172889-A1 PLEUROMUTILIN CINNAMIC ACID ESTER COMPOUNDS WITH ACTIVITIES AGAINST ANTIBIOTIC-RESISTANT INFECTIONS SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-06-08 US disclosed
US-20230172889-A1 PLEUROMUTILIN CINNAMIC ACID ESTER COMPOUNDS WITH ACTIVITIES AGAINST ANTIBIOTIC-RESISTANT INFECTIONS SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-06-08 US disclosed
US-11092549-B2 Fluorescent probes for drug permeability in gram negative bacteria SAINT LOUIS UNIVERSITY (US) 2021-08-17 US disclosed
WO-2020108481-A1 THIAMINE COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF 上海日馨生物科技有限公司 2020-06-04 WO disclosed
US-20150246908-A1 KLF5 MODULATORS UNITED STATES PATENT AND TRADEMARK OFFICE 2015-09-03 US disclosed
US-20150246908-A1 KLF5 MODULATORS UNITED STATES PATENT AND TRADEMARK OFFICE 2015-09-03 US disclosed
US-5017290-A Chromatography DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
US-4966694-A CELLULOSE TRI-BETA-NAPHTHOATE; OPTICAL RESOLUTIONS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-30 US disclosed
EP-0156382-B1 SEPARATION AGENT COMPRISING ACYL-OR CARBAMOYL-SUBSTITUTED POLYSACCHARIDE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-24 EP disclosed
US-4879038-A Separation agent comprising acyl- or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-11-07 US disclosed
EP-0156382-A2 Separation agent comprising acyl-or carbamoyl-substituted polysaccharide DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-02 EP disclosed
US-4348395-A 1,4-Dihydropyridazine compounds BAYER AKTIENGESELLSCHAFT (DE) 1982-09-07 US disclosed
US-4309444-A ANTICONVULSANT CINNAMAMIDES BURROUGHS WELLCOME CO. (US) 1982-01-05 US disclosed
US-4190674-A MUSCLE RELAXANT, OTHER HALOGENATED CINNAMIDES AS ANTICONVULSANTS BURROUGHS WELLCOME CO. (US) 1980-02-26 US disclosed
US-4107320-A Biologically active amides BURROUGHS WELLCOME CO. (US) 1978-08-15 US disclosed
US-3975435-A BACTERIOSTATS GIVAUDAN CORPORATION (US) 1976-08-17 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 (4 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-20230172889-A1 PLEUROMUTILIN CINNAMIC ACID ESTER COMPOUNDS WITH ACTIVITIES AGAINST ANTIBIOTIC-RESISTANT INFECTIONS RELA, PLEC, ABL1 CYP1A2 1415/4885CYP2C9 542/4885MAOB 3262/4885
US-20150246908-A1 KLF5 MODULATORS KLF5, KLF10, SREBF1 CYP1A2 3694/4885CYP2C9 3670/4885MAOB 4770/4885
US-11872202-B2 Pleuromutilin cinnamic acid ester compounds with activities against antibiotic-resistant infections RELA, PLEC, ABL1 CYP1A2 1415/4885CYP2C9 542/4885MAOB 3262/4885
US-11092549-B2 Fluorescent probes for drug permeability in gram negative bacteria SLC47A2, SLC47A1, ABCB11 CYP1A2 3956/4885CYP2C9 3109/4885MAOB 1453/4885

“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.