SCHEMBL4306789

SCHEMBL4306789

CC(C)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)nn4c3CCC4)nn12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 8/20 0.65
MAP4K4 O95819 7/20 0.65
PRKD2 Q9BZL6 6/20 0.65
EGFR P00533 5/20 0.65
MAPK9 P45984 4/20 0.65
MINK1 Q8N4C8 4/20 0.65
PRKD3 O94806 6/20 0.54
KDR P35968 1/20 0.44
CLK2 P49760 1/20 0.44
GSK3A P49840 1/20 0.44
SLK Q9H2G2 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
MAPK14 Q16539 7/20 0.41
THRB P10828 6/20 0.38
TGFBR1 P36897 5/20 0.38
ERBB2 P04626 1/20 0.35
MARK3 P27448 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
TAOK1 Q7L7X3 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
SCHEMBL4300827 0.84 MAP4K4 (0.57) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4296505 0.82 MAP4K4 (0.56) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL9056922 0.79 MAP4K4 (0.64) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4304066 0.79 CSNK1D (1.00) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4300842 0.77 MAP4K4 (0.64) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4302811 0.77 MAP4K4 (0.59) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4303245 0.77 MAP4K4 (0.57) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4303988 0.76 CSNK1D (0.95) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL8990765 0.76 MAP4K4 (0.56) CSNK1DMAP4K4PRKD2EGFRMAPK9
SCHEMBL4299756 0.76 MAP4K4 (0.58) CSNK1DMAP4K4PRKD2EGFRMAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180086764-A1 TGF-ß Inhibitors MIDCAP FINANCIAL TRUST 2018-03-29 US claimed
US-12227508-B2 TGF-β inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2025-02-18 US disclosed
US-20230123591-A1 TGF-ß INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2023-04-20 US disclosed
US-11466018-B2 TGF-β inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2022-10-11 US disclosed
US-20210130361-A1 TGF-ß INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-05-06 US disclosed
US-10822337-B2 TGF-β inhibitorC RIGEL PHARMACEUTICALS, INC. (US) 2020-11-03 US disclosed
US-20180086764-A1 TGF-ß Inhibitors MIDCAP FINANCIAL TRUST 2018-03-29 US disclosed
US-8188083-B2 Triazolopyridazines ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-8188083-B2 Triazolopyridazines ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-8188083-B2 Triazolopyridazines ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-20090270402-A1 Novel triazolopyridazines ABBVIE INC. 2009-10-29 US disclosed
US-20090270402-A1 Novel triazolopyridazines ABBVIE INC. 2009-10-29 US disclosed
US-20090270402-A1 Novel triazolopyridazines ABBVIE INC. 2009-10-29 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 (7 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-20090270402-A1 Novel triazolopyridazines MAP3K5, MAP3K1, MAP3K2 CSNK1D 173/4885MAP4K4 24/4885PRKD2 76/4885
US-12227508-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 CSNK1D 829/4885MAP4K4 2507/4885PRKD2 3485/4885
US-10822337-B2 TGF-β inhibitorC TGFBR1, TGFBR2, TGFB1 CSNK1D 799/4885MAP4K4 2342/4885PRKD2 3871/4885
US-11466018-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 CSNK1D 829/4885MAP4K4 2507/4885PRKD2 3485/4885
US-20210130361-A1 TGF-ß INHIBITORS TGFBR1, TGFBR2, TGFB1 CSNK1D 746/4885MAP4K4 2626/4885PRKD2 3527/4885
US-20180086764-A1 TGF-ß Inhibitors TGFBR1, TGFBR2, TGFB1 CSNK1D 746/4885MAP4K4 2626/4885PRKD2 3527/4885
US-20230123591-A1 TGF-ß INHIBITORS TGFBR1, TGFBR2, TGFB1 CSNK1D 746/4885MAP4K4 2626/4885PRKD2 3527/4885

“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.