SCHEMBL14924464

SCHEMBL14924464

Cc1cc(F)c(NCCN(C)C)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 2/20 0.41
NCF1 P14598 1/20 0.40
NOS1 P29475 1/20 0.38
DNM2 P50570 9/20 0.37
BPTF Q12830 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SYK P43405 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
SCHEMBL17450451 0.83 HTT (0.39) NOS2NCF1NOS1DNM2BPTF
SCHEMBL14924060 0.80 FLT3 (0.39) NCF1DNM2BPTFCYP2C19
SCHEMBL16790696 0.78 TRPA1 (0.43) RAPGEF4CYP2C19HTT
SCHEMBL14924462 0.77 NCF1 (0.43) NCF1HTTSMN1; SMN2SYK
SCHEMBL18403913 0.76 RAPGEF4 (0.38) NOS2NOS1RAPGEF4CYP2C19HTT
SCHEMBL17573454 0.76 NOS2 (0.56) NOS2NCF1NOS1DNM2RAPGEF4
SCHEMBL22996779 0.73 ALDH1A1 (0.43) RAPGEF4SMN1; SMN2
SCHEMBL15296541 0.70 HTT (0.54) HTTSMN1; SMN2
SCHEMBL11187910 0.70 DNM2 (0.55) NOS2NCF1NOS1DNM2CYP2C19
SCHEMBL81430 0.69 MAPT (0.67) NOS2NOS1CYP2C19HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE46511-E1 Fused pyrimidine derivatives for inhibition of tyrosine kinase activity HANMI SCIENCE CO., LTD. (KR) 2017-08-15 US disclosed
US-20160229868-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY HANMI SCIENCE CO., LTD (KR) 2016-08-11 US disclosed
US-9345719-B2 Fused pyrimidine derivatives for inhibition of tyrosine kinase activity HANMI SCIENCE CO., LTD. (KR) 2016-05-24 US disclosed
US-8957065-B2 Fused pyrimidine derivatives for inhibition of tyrosine kinase activity HANMI SCIENCE CO., LTD (KR) 2015-02-17 US disclosed
US-20150045324-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY HANMI SCIENCE CO., LTD (KR) 2015-02-12 US disclosed
US-20130116213-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY HANMI SCIENCE CO., LTD. (KR) 2013-05-09 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 (3 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-20160229868-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY LCK, LTK, FYN NOS2 2221/4885NCF1 501/4885NOS1 2095/4885
US-20150045324-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY LCK, FYN, TYK2 NOS2 2401/4885NCF1 504/4885NOS1 2184/4885
US-20130116213-A1 NOVEL FUSED PYRIMIDINE DERIVATIVES FOR INHIBITION OF TYROSINE KINASE ACTIVITY LCK, FYN, TYK2 NOS2 2401/4885NCF1 504/4885NOS1 2184/4885

“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.