SCHEMBL2146608

SCHEMBL2146608

CCn1ccc(C#N)c1-c1c(C(N)=O)c2ccccc2n1-c1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP14 P54578 2/20 0.39
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 1/20 0.35
STAT3 P40763 1/20 0.34
POLB P06746 1/20 0.34
HK1 P19367 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HKDC1 Q2TB90 1/20 0.34
TSHR P16473 1/20 0.34
EGFR P00533 1/20 0.33
SRC P12931 1/20 0.33
AR P10275 1/20 0.33
RECQL P46063 1/20 0.33
GALR3 O60755 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
BRCA1 P38398 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL2146335 0.80 ESR2 (0.43) USP14ALDH1A1KDM4ESTAT3HK1
SCHEMBL2146611 0.79 MAPT (0.35) USP14ALDH1A1KDM4EMAPTPOLB
SCHEMBL2146452 0.77 MEN1 (0.36) USP14ALDH1A1KDM4EMAPTSTAT3
SCHEMBL2146618 0.76 USP14 (0.34) USP14ALDH1A1KDM4EMAPTSTAT3
SCHEMBL30385406 0.73 AGTR1 (0.46) ALDH1A1KDM4EMAPTPOLBSMN1; SMN2
SCHEMBL1075323 0.73 AGTR1 (0.46) ALDH1A1KDM4EMAPTPOLBSMN1; SMN2
SCHEMBL28285318 0.71 IL1R1 (0.46) ALDH1A1KDM4EMAPTPOLBSMN1; SMN2
SCHEMBL1075834 0.68 ESR1 (0.37) USP14ALDH1A1SMN1; SMN2EGFRSRC
SCHEMBL1076542 0.68 EGFR (0.41) USP14KDM4EMAPTPOLBSMN1; SMN2
SCHEMBL30385665 0.68 EGFR (0.42) KDM4EMAPTPOLBSMN1; SMN2EGFR

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-20110201555-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-08-18 US claimed
EP-2346824-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-07-27 EP disclosed
WO-2010031852-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2010-03-25 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-20110201555-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 USP14 3060/4885ALDH1A1 1197/4885KDM4E 774/4885

“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.