SCHEMBL2977248

SCHEMBL2977248

CN(C)c1ccc2nc(-c3ccccc3-c3ncc[nH]3)[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TCF4 P15884 1/20 0.46
CTNNB1 P35222 1/20 0.46
NPC1 O15118 5/20 0.44
RAB9A P51151 4/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SYK P43405 1/20 0.43
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
AURKA O14965 2/20 0.41
METAP2 P50579 1/20 0.41
METAP1 P53582 1/20 0.41
CBFB Q13951 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL13203468 0.86 IDO1 (0.43) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203493 0.83 NPC1 (0.64) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203476 0.81 IDO1 (0.41) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203529 0.80 NPC1 (0.61) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL2977111 0.80 GAA (0.60) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203487 0.80 NPC1 (0.63) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203537 0.80 METAP2 (0.63) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL2978472 0.80 TCF4 (0.46) TCF4CTNNB1NPC1RAB9AKDM4E
SCHEMBL13203396 0.79 NPC1 (0.60) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13203479 0.78 TCF4 (0.48) TCF4CTNNB1NPC1RAB9AKDM4E

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-7777051-B2 Asymmetric benzimidazoles and related compounds as potassium channel modulators ICAGEN, INC. (US) 2010-08-17 US disclosed
US-7777051-B2 Asymmetric benzimidazoles and related compounds as potassium channel modulators ICAGEN, INC. (US) 2010-08-17 US disclosed
US-7777051-B2 Asymmetric benzimidazoles and related compounds as potassium channel modulators ICAGEN, INC. (US) 2010-08-17 US disclosed
US-20050038067-A1 Asymmetric benzimidazoles and related compounds as potassium channel modulators ICAGEN, INC. (US) 2005-02-17 US disclosed
WO-2005002503-A2 ASYMMETRIC BENZIMIDAZOLES AND RELATED COMPOUNDS AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2005-01-13 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-20050038067-A1 Asymmetric benzimidazoles and related compounds as potassium channel modulators KCNJ2, KCNJ1, KCNJ11 TCF4 1744/4885CTNNB1 2008/4885NPC1 709/4885

“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.