SCHEMBL19429012

SCHEMBL19429012

CN(C)Cc1ccc2c(c1)sc1ccc(CN(C)CN(C)C)cc12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
PIM1 P11309 3/20 0.35
PIM2 Q9P1W9 3/20 0.35
ILK Q13418 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
F10 P00742 1/20 0.34
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
PIM3 Q86V86 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL19429051 1.00 CA2 (0.39) CA2PIM1PIM2ILKHRH3
SCHEMBL19239050 0.91 CA2 (0.44) CA2PIM1PIM2ILKHRH3
SCHEMBL19429087 0.87 GPR3 (0.42) ALDH1A1TSHRLMNA
SCHEMBL19429003 0.87 ALDH1A1 (0.44) PIM1PIM2ALDH1A1TSHRLMNA
SCHEMBL19239128 0.84 CA2 (0.40) CA2PIM1PIM2ILKHRH3
SCHEMBL19429017 0.77 CYP2D6 (0.38) CA2PIM1PIM2TSHRLMNA
SCHEMBL19429090 0.77 CYP2D6 (0.38) CA2ILKF10TSHRLMNA
SCHEMBL19239053 0.70 TSHR (0.41) CA2PIM1PIM2HRH3F10
SCHEMBL13921921 0.69 KMT2A (0.40) ALDH1A1TSHRGAATAAR1HTR7
SCHEMBL19239051 0.69 CA2 (0.37) CA2PIM1PIM2HRH3ALDH1A1

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-20170288148-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-10-05 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-20170288148-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF OCIAD1, GPX1, PIEZO1 CA2 1298/4885PIM1 1339/4885PIM2 1666/4885

“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.