SCHEMBL12225151

SCHEMBL12225151

CC(C)(C)OC(=O)N1CCC(CNc2cncc(Nc3ccc4c5c([nH]c4n3)CCCC5)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD3 Q15059 2/20 0.45
PRMT5 O14744 1/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
GPR119 Q8TDV5 4/20 0.40
SYK P43405 1/20 0.39
BCDIN3D Q7Z5W3 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
CCNT1 O60563 1/20 0.39
CDK9 P50750 1/20 0.39
BUB1 O43683 1/20 0.39
BRD4 O60885 1/20 0.39
TGFBR1 P36897 3/20 0.38
JAK1 P23458 1/20 0.37
KDM1A O60341 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
SCHEMBL12225226 0.82 MEN1 (0.36) IDO1TDO2KDM4EJAK1
SCHEMBL12205348 0.82 JAK1 (0.44) PRMT5IDO1TDO2GPR119SYK
SCHEMBL12205234 0.80 EHMT2 (0.36) BRD3CCNT1CDK9BRD4
SCHEMBL12205335 0.79 KDM4E (0.55) IDO1TDO2GPR119SYKBCDIN3D
SCHEMBL12132010 0.79 BRD3 (0.41) BRD3GPR119KDM4EJAK1
SCHEMBL12132079 0.78 BTK (0.41) BRD3GPR119KDM4EJAK1
SCHEMBL12247504 0.77 KDM4E (0.51) IDO1TDO2GPR119SYKBCDIN3D
SCHEMBL12284988 0.76 BRD3 (0.42) BRD3KDM4EJAK1
SCHEMBL12127798 0.76 DDB1 (0.37) BRD3GPR119KDM4EJAK1
SCHEMBL12127873 0.75 DDB1 (0.37) BRD3GPR119KDM4EJAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110256064-A1 Novel Compounds for the Treatment of Diseases Associated with Amyloid or Amyloid-like Proteins AC IMMUNE, S.A. (CH) 2011-10-20 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 (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-20110256064-A1 Novel Compounds for the Treatment of Diseases Associated with Amyloid or Amyloid-like Proteins APP, PSEN1, PSEN2 BRD3 2053/4885PRMT5 3112/4885IDO1 3990/4885

“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.