SCHEMBL1362095

SCHEMBL1362095

Cc1ccccc1C(=O)c1c[nH]c2nccc(-c3cccc(C=CC(=O)O)c3)c12

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 1/20 0.47
BTK Q06187 16/20 0.42
LRRK2 Q5S007 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 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
SCHEMBL856856 1.00 PIM2 (0.47) PIM2BTKLRRK2MEN1KMT2A
SCHEMBL1363358 0.90 PIM2 (0.46) PIM2BTKLRRK2
SCHEMBL857089 0.90 PIM2 (0.46) PIM2BTKLRRK2
SCHEMBL858333 0.89 PIM2 (0.44) PIM2LRRK2MEN1KMT2AALDH1A1
SCHEMBL1363631 0.89 PIM2 (0.44) PIM2LRRK2MEN1KMT2AALDH1A1
SCHEMBL1364351 0.87 PIM2 (0.45) PIM2BTKLRRK2ALDH1A1
SCHEMBL857900 0.87 PIM2 (0.45) PIM2BTKLRRK2ALDH1A1
SCHEMBL857700 0.86 PIM2 (0.42) PIM2LRRK2MEN1KMT2AALDH1A1
SCHEMBL1363277 0.86 PIM2 (0.42) PIM2LRRK2MEN1KMT2AALDH1A1
SCHEMBL858149 0.85 PIM2 (0.44) PIM2LRRK2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067434-B2 Compounds and methods for development of Ret modulators PLEXXIKON INC. (US) 2011-11-29 US claimed
US-20100324065-A1 Compounds and methods for development of Ret Modulators PLEXXIKON INC 2010-12-23 US claimed
US-7504509-B2 Compounds and methods for development of Ret modulators PLEXXIKON, INC. (US) 2009-03-17 US claimed

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-20100324065-A1 Compounds and methods for development of Ret Modulators RET, GFRA3, GFRA1 PIM2 2832/4885BTK 1809/4885LRRK2 96/4885

“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.