SCHEMBL19835339

SCHEMBL19835339

COC(=O)c1cnc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 7/20 0.49
MAP2K4 P45985 1/20 0.49
SLC6A4 P31645 1/20 0.49
SLC6A3 Q01959 1/20 0.49
GABRA5 P31644 1/20 0.48
PDGFRB P09619 2/20 0.48
KDR P35968 2/20 0.48
CSNK2A2 P19784 1/20 0.48
CSNK2B P67870 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
CNR1 P21554 4/20 0.47
KDM1A O60341 1/20 0.46
HDAC1 Q13547 1/20 0.46
DHODH Q02127 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
SCHEMBL28414233 0.94 MALT1 (0.57) MALT1MAP2K4GABRA5CSNK2A2CSNK2B
SCHEMBL5207938 0.90 PTGS2 (0.57) MALT1GABRA5POLBMAPTMAPK1
SCHEMBL5359287 0.88 CNR1 (0.62) CNR1
SCHEMBL30791358 0.87 CTSA (0.55) SLC6A4SLC6A3PDGFRBKDRCSNK2A2
SCHEMBL28642445 0.87 CTSA (0.55) SLC6A4SLC6A3PDGFRBKDRCSNK2A2
SCHEMBL2490941 0.87 SLC6A4 (0.50) MAP2K4SLC6A4SLC6A3GABRA5PDGFRB
SCHEMBL19835442 0.84 CNR1 (0.49) MALT1MAPTCNR1HDAC1
SCHEMBL28419710 0.81 MALT1 (0.53) MALT1POLBMAPTCNR1KDM1A
SCHEMBL2703081 0.79 CNR1 (0.65) SLC6A4SLC6A3CNR1
SCHEMBL12949210 0.79 MAPK1 (0.50) MAP2K4SLC6A4SLC6A3GABRA5KDR

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10662156-B2 Guanidine derivative and medical use thereof TORAY INDUSTRIES, INC. (JP) 2020-05-26 US disclosed
US-10662156-B2 Guanidine derivative and medical use thereof TORAY INDUSTRIES, INC. (JP) 2020-05-26 US disclosed
US-20190233376-A1 GUANIDINE DERIVATIVE AND MEDICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2019-08-01 US disclosed
US-20190233376-A1 GUANIDINE DERIVATIVE AND MEDICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2019-08-01 US disclosed
EP-3495348-A1 GUANIDINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Toray Industries, Inc. (JP) 2019-06-12 EP disclosed
EP-3495348-A1 GUANIDINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Toray Industries, Inc. (JP) 2019-06-12 EP disclosed
WO-2018021520-A1 GUANIDINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES 東レ株式会社 2018-02-01 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 (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-20190233376-A1 GUANIDINE DERIVATIVE AND MEDICAL USE THEREOF MALT1, GUCY1A1, GUCY1B1 MALT1 1/4885MAP2K4 2513/4885SLC6A4 3821/4885
US-10662156-B2 Guanidine derivative and medical use thereof MALT1, GUCY1A1, GUCY1B1 MALT1 1/4885MAP2K4 2513/4885SLC6A4 3821/4885

“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.