SCHEMBL15760925

SCHEMBL15760925

CCc1cc(NC)c2c(=O)[nH]ccc2n1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.38
KCNH2 Q12809 2/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TYK2 P29597 1/20 0.34

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
SCHEMBL15803490 0.79 JAK2 (0.40) JAK2KCNH2TYK2
SCHEMBL15760953 0.75 PDPK1 (0.39) KDM4EALDH1A1HPGD
SCHEMBL15760939 0.75 ZAP70 (0.40) JAK2KCNH2
SCHEMBL15803489 0.72 JAK2 (0.41) JAK2KCNH2TYK2
SCHEMBL11327610 0.66 JAK2 (0.52) JAK2
SCHEMBL15760947 0.66 PARP1 (0.38) JAK2KCNH2
SCHEMBL2349754 0.63
SCHEMBL2460195 0.63 CHEK1 (0.51) JAK2KCNH2
SCHEMBL4747249 0.62 JAK2 (0.43) JAK2KDM4EALDH1A1
SCHEMBL21987955 0.62 JAK2 (0.39) JAK2KCNH2KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140171429-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-19 US disclosed
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-05 US disclosed
US-20130156721-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY CERULEAN PHARMA INC. (US) 2013-06-20 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-20140171429-A1 BICYCLIC INHIBITORS OF ALK ALK, ACVR1, ACVR1B JAK2 104/4885KCNH2 485/4885KDM4E 778/4885
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ALK, ABL1, BOD1L1 JAK2 95/4885KCNH2 573/4885KDM4E 838/4885
US-20130156721-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY DDOST, DSC1, SI JAK2 2339/4885KCNH2 4447/4885KDM4E 3582/4885

“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.