SCHEMBL1363520

SCHEMBL1363520

CCN(C(C)C)C(C)C.OCCN1CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.37
CHRM3 P20309 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CXCR4 P61073 2/20 0.34
SIGMAR1 Q99720 2/20 0.33
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 2/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
RECQL P46063 1/20 0.32
ANPEP P15144 1/20 0.32
ERAP2 Q6P179 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
OPRD1 P41143 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
NPC1 O15118 1/20 0.31

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
Propane SCHEMBL3983227 0.81 SMN1; SMN2 (0.45) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
Methyl Alcohol SCHEMBL28005726 0.79 SMN1; SMN2 (0.46) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
Ethane SCHEMBL323446 0.79 SMN1; SMN2 (0.46) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
SCHEMBL8373240 0.79 POLB (0.50) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
SCHEMBL361682 0.79
SCHEMBL1194 0.79
Ethane SCHEMBL28152828 0.77 SMN1; SMN2 (0.45) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
SCHEMBL7683711 0.77 CXCR4 (0.52) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
SCHEMBL12958863 0.77 KDM4E (0.50) CHRM5CHRM3SMN1; SMN2POLBHSD17B10
Ammonia Solution, Strong SCHEMBL7216847 0.77 POLB (0.48) CHRM5CHRM3SMN1; SMN2POLBHSD17B10

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-2508523-B2 Polymorphs of dasatinib and process for preparation thereof TEVA PHARMA (IL) 2019-04-17 EP disclosed
EP-2508523-B1 Polymorphs of dasatinib and process for preparation thereof TEVA PHARMA (IL) 2016-02-17 EP disclosed
EP-2537847-A1 Polymorphs of dasatinib and process for preparation thereof TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2012-12-26 EP disclosed
EP-2508523-A2 Polymorphs of dasatinib and process for preparation thereof Teva Pharmaceutical Industries Ltd. (IL) 2012-10-10 EP disclosed
US-8067423-B2 Polymorphs of dasatinib isopropyl alcohol and process for preparation thereof TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-11-29 US disclosed
US-7973045-B2 Anhydrous form of dasatinib and process for preparation thereof TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-07-05 US disclosed
US-20100256158-A1 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2010-10-07 US disclosed
EP-2207777-A2 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF Teva Pharmaceutical Industries Ltd. (IL) 2010-07-21 EP disclosed
US-20090118297-A1 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2009-05-07 US disclosed
WO-2009053854-A2 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-04-30 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-20100256158-A1 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF NRAS, SRC, TP53 CHRM5 4637/4885CHRM3 4245/4885SMN1; SMN2 2398/4885
US-20090118297-A1 POLYMORPHS OF DASATINIB AND PROCESS FOR PREPARATION THEREOF NRAS, SRC, TP53 CHRM5 4637/4885CHRM3 4245/4885SMN1; SMN2 2398/4885

“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.