SCHEMBL1995864

SCHEMBL1995864

CN1CCN(c2nc(CC(N)=O)c3sccc3n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 2/20 0.43
PIK3CA P42336 2/20 0.43
HRH4 Q9H3N8 5/20 0.42
HTR3A P46098 4/20 0.42
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.41
GLA P06280 1/20 0.41
HTR6 P50406 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NOD2 Q9HC29 1/20 0.39

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
SCHEMBL1992580 0.81 GGPS1 (0.42) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1993681 0.80 HRH4 (0.61) HRH4HTR3AKDM4EHTTGLA
SCHEMBL2001802 0.77 HRH4 (0.50) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1994195 0.77 HRH4 (0.57) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1995226 0.77 LATS1 (0.45) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1993409 0.77 HRH4 (0.50) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1991112 0.76 HRH4 (0.65) HRH4HTR3AKDM4EALDH1A1NPSR1
SCHEMBL1990158 0.76 HRH4 (0.49) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1993947 0.76 PRKCB (0.45) HRH4HTR3AKDM4EHTTGLA
SCHEMBL1993565 0.76 HRH4 (0.46) HRH4HTR3AKDM4EHTTGLA

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-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-23 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-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS TPMT, TSLP, THPO PIK3R1 2430/4885PIK3CA 1400/4885HRH4 249/4885

“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.