SCHEMBL2887162

SCHEMBL2887162

Cc1ccc2c(ncn2Cc2ccnc3ccccc23)c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.45
CYP11B1 P15538 2/20 0.45
CYP11B2 P19099 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
TP53 P04637 1/20 0.44
BRD4 O60885 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.42
TNF P01375 1/20 0.41
HTT P42858 3/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NCF1 P14598 1/20 0.38
MAPK1 P28482 1/20 0.38
POLB P06746 1/20 0.37
HRH2 P25021 1/20 0.37
ADRA1D P25100 1/20 0.37

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
SCHEMBL2881621 0.81 BRD4 (0.49) LMNACYP11B1CYP11B2SMN1; SMN2BRD4
SCHEMBL2886668 0.81 MEN1 (0.54) CYP11B1CYP11B2SMN1; SMN2TP53BRD4
SCHEMBL2887658 0.74 LMNA (0.54) LMNACYP11B1CYP11B2SMN1; SMN2BRD4
SCHEMBL2882688 0.71 POLB (0.49) LMNASMN1; SMN2BRD4HTTALDH1A1
SCHEMBL17987142 0.65 CYP11B1 (0.69) LMNACYP11B1CYP11B2SMN1; SMN2TNF
SCHEMBL3968269 0.63 MAPT (0.50) LMNACYP11B1CYP11B2SMN1; SMN2TP53
SCHEMBL13508757 0.62 LMNA (1.00) LMNACYP11B1CYP11B2SMN1; SMN2BRD4
SCHEMBL3343150 0.62 LMNA (0.66) LMNASMN1; SMN2TP53HTTALDH1A1
SCHEMBL1040581 0.62 LOXL2 (0.55) LMNASMN1; SMN2LOXL2ALDH1A1KDM4E
SCHEMBL9572807 0.62 LOXL2 (0.64) LMNASMN1; SMN2TP53LOXL2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222421-B2 Certain substituted ureas, as modulators of kinase activity GILEAD CONNECTICUT, INC. (US) 2012-07-17 US disclosed
US-8222421-B2 Certain substituted ureas, as modulators of kinase activity GILEAD CONNECTICUT, INC. (US) 2012-07-17 US disclosed
US-8222421-B2 Certain substituted ureas, as modulators of kinase activity GILEAD CONNECTICUT, INC. (US) 2012-07-17 US disclosed
US-20100286190-A1 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. 2010-11-11 US disclosed
US-20100286190-A1 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. 2010-11-11 US disclosed
US-20100286190-A1 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. 2010-11-11 US disclosed
US-7777040-B2 Certain substituted ureas, as modulators of kinase activity CGI PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
US-7777040-B2 Certain substituted ureas, as modulators of kinase activity CGI PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
US-7777040-B2 Certain substituted ureas, as modulators of kinase activity CGI PHARMACEUTICALS, INC. (US) 2010-08-17 US disclosed
WO-2007024294-A2 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. (US) 2007-03-01 WO disclosed
WO-2007024294-A2 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. (US) 2007-03-01 WO disclosed
US-20060270702-A1 Certain substituted ureas, as modulators of kinase activity GILEAD CONNECTICUT, INC. 2006-11-30 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 (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-20060270702-A1 Certain substituted ureas, as modulators of kinase activity UCK2, CHUK, TK1 LMNA 3766/4885CYP11B1 1608/4885CYP11B2 1796/4885
US-20100286190-A1 CERTAIN SUBSTITUTED UREAS, AS MODULATORS OF KINASE ACTIVITY UCK2, CHUK, TK1 LMNA 3766/4885CYP11B1 1608/4885CYP11B2 1796/4885

“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.