SCHEMBL19991802

SCHEMBL19991802

Fc1ccc(F)c(-c2nn3c(c2Br)CCC3)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.41
TGFBR1 P36897 10/20 0.40
CSNK1D P48730 3/20 0.40
CSNK1E P49674 2/20 0.40
MAPK14 Q16539 3/20 0.38
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPY5R Q15761 1/20 0.31

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
SCHEMBL2523005 0.83 THRB (0.42) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL14844873 0.80 THRB (0.53) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL18115090 0.79 CSNK1D (0.48) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL14844957 0.79 TGFBR1 (0.54) THRBTGFBR1CSNK1EMAPK14CYP11B1
SCHEMBL14844882 0.78 THRB (0.52) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL14844860 0.76 THRB (0.43) THRBTGFBR1CSNK1DCSNK1ECYP11B1
SCHEMBL17373680 0.75 THRB (0.49) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL24348532 0.75 TGFBR1 (0.56) THRBTGFBR1CSNK1DCSNK1EMAPK14
SCHEMBL29049906 0.75 TGFBR1 (0.55) THRBTGFBR1CSNK1DMAPK14
SCHEMBL18115007 0.74 THRB (0.51) THRBTGFBR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-3277673-B1 TGF-BETA INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-05-04 EP 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-12227508-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 THRB 102/4885TGFBR1 1/4885CSNK1D 829/4885
US-10822337-B2 TGF-β inhibitorC TGFBR1, TGFBR2, TGFB1 THRB 193/4885TGFBR1 1/4885CSNK1D 799/4885
US-11466018-B2 TGF-β inhibitors TGFBR1, TGFBR2, TGFB1 THRB 102/4885TGFBR1 1/4885CSNK1D 829/4885
US-20210130361-A1 TGF-ß INHIBITORS TGFBR1, TGFBR2, TGFB1 THRB 86/4885TGFBR1 1/4885CSNK1D 746/4885
US-20180086764-A1 TGF-ß Inhibitors TGFBR1, TGFBR2, TGFB1 THRB 86/4885TGFBR1 1/4885CSNK1D 746/4885
US-20230123591-A1 TGF-ß INHIBITORS TGFBR1, TGFBR2, TGFB1 THRB 86/4885TGFBR1 1/4885CSNK1D 746/4885

“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.