SCHEMBL19675658

SCHEMBL19675658

Cc1ccc2c(c1)c1c(n2C)-c2ccccc2C1(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NR1I2 O75469 1/20 0.43
AHR P35869 1/20 0.43
NTRK1 P04629 2/20 0.39
KDM4E B2RXH2 3/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
PGR P06401 1/20 0.37
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
GSK3B P49841 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
APAF1 O14727 1/20 0.35
PKM P14618 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL19978119 0.86 GSK3B (0.48) MEN1KMT2AACHEMAPTCCNB2
SCHEMBL17694816 0.83 GPR3 (0.44) MEN1KMT2ANTRK1KDM4EMAPT
SCHEMBL17012794 0.82 NTRK1 (0.41) MEN1KMT2ANR1I2AHRNTRK1
SCHEMBL19978099 0.82 CCNB2 (0.38) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL19978120 0.82 PGR (0.37) NTRK1KDM4EMAPTALDH1A1PGR
SCHEMBL19978096 0.82 ALDH1A1 (0.51) MEN1KMT2ANTRK1KDM4EBCHE
SCHEMBL19978114 0.80 PGR (0.34) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL19675716 0.79 KMT2A (0.47) MEN1KMT2ANTRK1MAPTALDH1A1
SCHEMBL19978107 0.79 PGR (0.33) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL19978108 0.78 ADRA2A (0.43) MEN1KMT2AKDM4EALDH1A1PGR

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-20180079841-A1 METALLOCENE SUPPORTED CATALYST AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME LG CHEM, LTD. (KR) 2018-03-22 US disclosed
US-20180079841-A1 METALLOCENE SUPPORTED CATALYST AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME LG CHEM, LTD. (KR) 2018-03-22 US disclosed
EP-3252064-A1 METALLOCENE COMPOUND LG Chem, Ltd. (KR) 2017-12-06 EP 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-20180079841-A1 METALLOCENE SUPPORTED CATALYST AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME PCBP1, SOD1, PCLAF MEN1 1003/4885KMT2A 1009/4885NR1I2 4240/4885

“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.