SCHEMBL12829657

SCHEMBL12829657

CCCc1ccc(-c2c(O)c(/C(C)=N/NC(=O)c3ccc(C(=O)O)cc3)nn2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
RARB P10826 6/20 0.39
PPARG P37231 1/20 0.38
PLK1 P53350 1/20 0.38
MTOR P42345 3/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
RARA P10276 1/20 0.38
POLB P06746 4/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
PTGS2 P35354 1/20 0.37
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL1483781 1.00 RAB9A (0.40) RAB9ANPC1SMN1; SMN2TP53RARB
SCHEMBL1483778 1.00 RAB9A (0.40) RAB9ANPC1SMN1; SMN2TP53RARB
SCHEMBL1483780 0.93 RARB (0.49) RAB9ANPC1SMN1; SMN2RARBPLK1
SCHEMBL1483777 0.93 RARB (0.49) RAB9ANPC1SMN1; SMN2RARBPLK1
SCHEMBL12755609 0.93 KDM4E (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL1483384 0.93 RARB (0.50) RAB9ANPC1SMN1; SMN2RARBPLK1
SCHEMBL13720365 0.93 RARB (0.50) RAB9ANPC1SMN1; SMN2RARBPLK1
SCHEMBL1483383 0.93 RARB (0.50) RAB9ANPC1SMN1; SMN2RARBPLK1
SCHEMBL1483886 0.92 MAPK1 (0.42) RAB9ANPC1SMN1; SMN2MTORALDH1A1
SCHEMBL1483887 0.92 MAPK1 (0.42) RAB9ANPC1SMN1; SMN2MTORALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636192-B9 3-ALKYLIDENEHYDRAZINO SUBSTITUTED HETEROARYL COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL IND LTD (JP) 2015-07-01 EP disclosed
EP-1636192-B1 3-ALKYLIDENEHYDRAZINO SUBSTITUTED HETEROARYL COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL IND LTD (JP) 2014-01-15 EP disclosed
US-20130012708-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2013-01-10 US disclosed
US-8318796-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20110077290-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2011-03-31 US disclosed
US-7576115-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-18 US disclosed
US-7576115-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-18 US disclosed
US-7351841-B2 Heterocyclic compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-04-01 US disclosed
US-20080027068-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2008-01-31 US disclosed
US-20080027068-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES LIMITED (JP) 2008-01-31 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 (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-20110077290-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NR2C2, ROR1, NR0B2 RAB9A 3863/4885NPC1 4084/4885SMN1; SMN2 2016/4885
US-20080027068-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NR2C2, ROR1, NR0B2 RAB9A 3877/4885NPC1 4068/4885SMN1; SMN2 1967/4885
US-20130012708-A1 HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NR2C2, ROR1, NR0B2 RAB9A 3863/4885NPC1 4084/4885SMN1; SMN2 2016/4885

“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.