SCHEMBL215204

SCHEMBL215204

NC(=O)c1[nH]cnc1C(=O)N(c1nc2ccccc2[nH]1)c1cc(Cl)ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
MAPT P10636 4/20 0.37
POLB P06746 2/20 0.35
NPC1 O15118 8/20 0.34
RAB9A P51151 7/20 0.34
KDM4E B2RXH2 4/20 0.34
MEN1 O00255 3/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 2/20 0.34
HTT P42858 2/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALPL P05186 1/20 0.34
GLA P06280 1/20 0.34
ALPG P10696 1/20 0.34
PKM P14618 1/20 0.34
MAP2 P11137 1/20 0.33
IKBKB O14920 1/20 0.33
CHUK O15111 1/20 0.33

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
SCHEMBL214939 0.91 POLB (0.36) KMT2AMAPTPOLBNPC1RAB9A
SCHEMBL214647 0.90 POLB (0.38) MAPTPOLBNPC1RAB9AKDM4E
SCHEMBL215085 0.90 GRM2 (0.35) KMT2AMAPTPOLBNPC1RAB9A
SCHEMBL213501 0.88 POLB (0.44) KMT2AMAPTPOLBNPC1RAB9A
SCHEMBL214043 0.88 POLB (0.47) KMT2AMAPTPOLBNPC1RAB9A
SCHEMBL214977 0.84 POLB (0.38) MAPTPOLBNPC1RAB9AKDM4E
SCHEMBL214451 0.84 POLB (0.37) KMT2APOLBNPC1RAB9AKDM4E
SCHEMBL214715 0.82 POLB (0.40) KMT2APOLBNPC1RAB9AKDM4E
SCHEMBL214461 0.82 RAB9A (0.36) RAB9ATDP1
SCHEMBL215645 0.82 POLB (0.37) KMT2AMAPTPOLBRAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US claimed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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 (1 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 KMT2A 437/4885MAPT 2138/4885POLB 3464/4885

“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.