SCHEMBL19661563

SCHEMBL19661563

CCCNC(=O)Nc1cnc(-c2ccc(F)c(C)c2)c(-c2ccc(NC(=O)NCCC)c(C=N)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ABL1 P00519 4/20 0.38
▸ KIT P10721 2/20 0.37
▸ NTRK1 P04629 2/20 0.36
▸ KDR P35968 4/20 0.36
▸ KRAS P01116 2/20 0.36
▸ RAF1 P04049 2/20 0.36
▸ BRAF P15056 2/20 0.36
▸ ROCK2 O75116 2/20 0.36
▸ LIMK1 P53667 2/20 0.36
▸ EPHX2 P34913 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ LCK P06239 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ LYN P07948 1/20 0.34

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
SCHEMBL18306364 0.82 ABL1 (0.40) KMT2APOLBABL1KITKDR
SCHEMBL18712024 0.78 RAB9A (0.38) MEN1KMT2APOLBMAPTABL1
SCHEMBL18306350 0.77 TGFBR1 (0.39) ABL1KITNTRK1KDRLCK
SCHEMBL19654959 0.77 TGFBR1 (0.40) KITKDRROCK2LIMK1LCK
SCHEMBL19661652 0.73 DHODH (0.38) MAPTKDRRAF1BRAFMAPK1
SCHEMBL15638949 0.70 GRM2 (0.46) ABL1KDR
SCHEMBL17177325 0.70 ABL1 (0.36) ABL1KITNTRK1KDRBRAF
SCHEMBL18306371 0.70 TGFBR1 (0.40) MEN1KMT2ANTRK1KDRCSF1R
SCHEMBL15637353 0.69 TGFBR1 (0.47) MEN1KMT2A
SCHEMBL18306360 0.68 IRAK4 (0.35) NTRK1KDRBRAFCSF1RFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10233170-B2 2,3-disubstituted pyridine compounds as TGF-beta inhibitors and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2019-03-19 — — US disclosed
US-20170342048-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2017-11-30 — — 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 (2 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-10233170-B2 2,3-disubstituted pyridine compounds as TGF-beta inhibitors and methods of use TGFBR1, TGFBR2, ACVR1 MEN1 1279/4885KMT2A 3459/4885POLB 2333/4885
US-20170342048-A1 GDF-8 Inhibitors MSTN, MYOF, CXCL8 MEN1 444/4885KMT2A 4190/4885POLB 3905/4885

“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.

Send feedback