SCHEMBL18918796

SCHEMBL18918796

CNC(=O)Nc1ccc(-c2cnc3[nH]c(-c4ccccc4)cc3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIT P10721 9/20 0.51
BRD4 O60885 1/20 0.48
ULK1 O75385 3/20 0.47
PIK3CG P48736 1/20 0.47
RIPK1 Q13546 2/20 0.46
PIP4K2A P48426 1/20 0.46
PIP4K2B P78356 1/20 0.46
KDR P35968 1/20 0.45
IGF1R P08069 1/20 0.44
HDAC6 Q9UBN7 1/20 0.42
CNR1 P21554 1/20 0.42

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
SCHEMBL18932409 0.86 KIT (0.52) KITBRD4ULK1PIK3CGRIPK1
SCHEMBL8906555 0.76 ALDH1A1 (0.60) CNR1
SCHEMBL1780760 0.75 RIPK1 (0.61) KITBRD4ULK1RIPK1HDAC6
SCHEMBL15825553 0.75 KIT (0.69) KITBRD4
SCHEMBL2060048 0.72 HDAC6 (0.54) KITBRD4ULK1PIK3CGRIPK1
SCHEMBL22777821 0.72 AXL (0.50) ULK1RIPK1KDR
SCHEMBL28370123 0.71 KIT (0.57) KITULK1
SCHEMBL3318931 0.71 KIT (0.52) KIT
SCHEMBL30469384 0.71 ULK1 (0.69) KITULK1
SCHEMBL18918892 0.70 ULK1 (0.57) KITBRD4ULK1PIK3CGKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938273-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2018-04-10 US claimed
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-06-08 US claimed
EP-3386980-B1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2021-10-13 EP disclosed
US-9938273-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2018-04-10 US disclosed
US-9938273-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2018-04-10 US disclosed
US-9938273-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2018-04-10 US disclosed
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-06-08 US disclosed
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-06-08 US disclosed
US-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-06-08 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-20170158690-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K11, MAP3K13, WEE2 KIT 1525/4885BRD4 1388/4885ULK1 495/4885

“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.