SCHEMBL1647857

SCHEMBL1647857

C=CCNC(=S)Nc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.69
MAPT P10636 1/20 0.69
MAPK1 P28482 1/20 0.69
GAA P10253 1/20 0.63
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
LMNA P02545 1/20 0.61
KDM4E B2RXH2 1/20 0.61
MAOA P21397 2/20 0.59
MAOB P27338 2/20 0.59
CYP3A4 P08684 1/20 0.59
TAS2R38 P59533 1/20 0.59
HSD17B10 Q99714 1/20 0.59
ABAT P80404 1/20 0.58
POLB P06746 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL31459385 0.87 LSS (0.59) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL9779693 0.85 GAA (0.67) ALDH1A1MAPTGAAKMT2AMEN1
Morpholine SCHEMBL28680895 0.84 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL5450539 0.83 MAPT (0.71) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL2236429 0.83 GAA (0.66) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL31459126 0.82 BCL6 (0.58) ALDH1A1MAPTMAPK1GAAKDM4E
SCHEMBL3888050 0.82 RAB9A (0.65) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL5448347 0.81 GAA (0.64) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL8611437 0.81 GAA (0.64) ALDH1A1MAPTMAPK1GAAKMT2A
SCHEMBL2856729 0.81 GAA (0.59) ALDH1A1MAPTMAPK1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109456741-B Clay stabilizer and preparation method thereof 西南石油大学 2020-11-06 CN claimed
CN-109456741-A A kind of clay stabilizer and preparation method thereof 西南石油大学 2019-03-12 CN claimed
US-4036986-A Fungicidal N-(4-halobenzyl)-N-sec. alkyl-N'-phenylthioureas BAYER AKTIENGESELLSCHAFT (DT) 1977-07-19 US claimed
CN-117164482-A Ionic compound and method for synthesizing cyclic carbonate by catalysis 华南理工大学 2023-12-05 CN disclosed
CN-109456741-B Clay stabilizer and preparation method thereof 西南石油大学 2020-11-06 CN disclosed
CN-109456741-B Clay stabilizer and preparation method thereof 西南石油大学 2020-11-06 CN disclosed
CN-109456741-A A kind of clay stabilizer and preparation method thereof 西南石油大学 2019-03-12 CN disclosed
CN-109456741-A A kind of clay stabilizer and preparation method thereof 西南石油大学 2019-03-12 CN disclosed
US-9126962-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N′-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-09-08 US disclosed
US-9023869-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N'-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-05 US disclosed
US-20150031726-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds MEDIVATION TECHNOLOGIES LLC 2015-01-29 US disclosed
US-4790912-A ELECTROLYTICALLY-GENERATED HYDROGEN AND CATALYST CONVERT METAL SALT IN BATH TO METAL TECHNO-INSTRUMENTS INVESTMENTS LTD. (IL) 1988-12-13 US disclosed
US-4749449-A PLATING ON CATALYZED THROUGH HOLE WALL IN PATTERENED CONDUCTIVE AND INSULATING LAYERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-06-07 US disclosed
US-4713382-A N-phenyl-4-phenyl-1-piperazinecarboxamidines and related compounds as antiarrhythmic agents SYNTEX (U.S.A.) INC. (US) 1987-12-15 US disclosed
EP-0204265-A1 N-Phenyl-4-phenyl-1-piperazine carboxamidines and related compounds as antiarrhythmic agents LABORATOIRES SYNTEX S.A. (FR) 1986-12-10 EP disclosed
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed
US-4036986-A Fungicidal N-(4-halobenzyl)-N-sec. alkyl-N'-phenylthioureas BAYER AKTIENGESELLSCHAFT (DT) 1977-07-19 US disclosed
US-4036986-A Fungicidal N-(4-halobenzyl)-N-sec. alkyl-N'-phenylthioureas BAYER AKTIENGESELLSCHAFT (DT) 1977-07-19 US disclosed
US-4036986-A Fungicidal N-(4-halobenzyl)-N-sec. alkyl-N'-phenylthioureas BAYER AKTIENGESELLSCHAFT (DT) 1977-07-19 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 (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-20150031726-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds AR, NAT1, NCOA1 ALDH1A1 2198/4885MAPT 2411/4885MAPK1 3873/4885

“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.