SCHEMBL19211657

SCHEMBL19211657

CC(C)N1CCN(Cc2ccc(B(O)O)cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 4/20 0.39
SOS1 Q07889 1/20 0.39
HRH3 Q9Y5N1 6/20 0.38
MTNR1B P49286 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
POLB P06746 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
SCHEMBL2554986 0.85 KDM4E (0.45) KDM4ESMN1; SMN2KMT2AALDH1A1HRH3
SCHEMBL19211675 0.83 CHKA (0.40) KDM4EALDH1A1HRH3MTNR1BTDP1
SCHEMBL29953357 0.81 KDM4E (0.64) KDM4ESMN1; SMN2ALDH1A1HRH3
SCHEMBL18704973 0.81 KDM4E (0.64) KDM4ESMN1; SMN2ALDH1A1SOS1TDP1
SCHEMBL15330847 0.81 KDM4E (0.52) KDM4ESMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL2562320 0.80 KDM4E (0.47) KDM4ESMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL20680179 0.79 KDM4E (0.45) KDM4ESMN1; SMN2ALDH1A1SOS1TDP1
SCHEMBL19211655 0.79 CHKA (0.38) KDM4EMEN1KMT2AATMALDH1A1
SCHEMBL428266 0.79 CYP2A13 (0.56) KDM4ESMN1; SMN2KMT2AALDH1A1TDP1
SCHEMBL30519205 0.78 KDM4E (0.44) KDM4ESMN1; SMN2ATMALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108884046-B Chemical compounds as inhibitors of kinase activity 葛兰素史克知识产权开发有限公司 2021-11-09 CN disclosed
US-10793559-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-06 US disclosed
US-10793559-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-06 US disclosed
EP-3414228-B1 CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY GLAXOSMITHKLINE IP DEV LTD (GB) 2020-03-18 EP disclosed
EP-3414228-B1 CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY GLAXOSMITHKLINE IP DEV LTD (GB) 2020-03-18 EP disclosed
US-20200071311-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-05 US disclosed
US-20200071311-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-05 US disclosed
US-10457674-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-10-29 US disclosed
US-10457674-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-10-29 US disclosed
US-20190040051-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-02-07 US disclosed
US-20190040051-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-02-07 US disclosed
EP-3414228-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-12-19 EP disclosed
WO-2017137535-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-08-17 WO disclosed
WO-2017137535-A1 CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-08-17 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 (4 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-10793559-B2 Chemical compounds PIK3CA, PIK3CD, PIK3C2B KDM4E 1914/4885SMN1; SMN2 4722/4885MEN1 1141/4885
US-20190040051-A1 CHEMICAL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B KDM4E 1914/4885SMN1; SMN2 4722/4885MEN1 1141/4885
US-20200071311-A1 CHEMICAL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B KDM4E 1914/4885SMN1; SMN2 4722/4885MEN1 1141/4885
US-10457674-B2 Chemical compounds PIK3CA, PIK3CD, PIK3C2B KDM4E 1914/4885SMN1; SMN2 4722/4885MEN1 1141/4885

“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.