SCHEMBL16473243

SCHEMBL16473243

CC(=O)Nc1cnc(-c2ccc(F)c(C)c2)c(-c2ccc3c(cnn3C(=O)NC(C)C)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.39
▸ RAB9A P51151 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ SHMT2 P34897 2/20 0.38
▸ ABL1 P00519 3/20 0.38
▸ NPC1 O15118 3/20 0.36
▸ GAA P10253 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ TGFBR1 P36897 2/20 0.35
▸ TGFBR2 P37173 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ SLC9A1 P19634 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ DGAT1 O75907 1/20 0.33
▸ GRIN2B Q13224 2/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33

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
SCHEMBL15639059 0.93 ABL1 (0.43) KMT2ARAB9AMAPTSHMT2ABL1
SCHEMBL18712024 0.80 RAB9A (0.38) KMT2ARAB9AMAPTSHMT2ABL1
SCHEMBL18306364 0.75 ABL1 (0.40) KMT2AABL1GAATGFBR1TGFBR2
SCHEMBL15638351 0.75 ROCK1 (0.52) RAB9AABL1NPC1TGFBR1MAPK14
SCHEMBL15638922 0.73 RAB9A (0.47) KMT2ARAB9AMAPTSHMT2NPC1
SCHEMBL16459670 0.72 KMO (0.43) KMT2ATGFBR1TGFBR2GRIN2BMAPK14
SCHEMBL16460372 0.71 KMT2A (0.40) KMT2AMAPTTGFBR1TGFBR2TP53
SCHEMBL19817527 0.71 KMT2A (0.44) KMT2ARAB9AMAPTNPC1TGFBR1
SCHEMBL18306350 0.70 TGFBR1 (0.39) ABL1TGFBR1TGFBR2GSK3BMAPK14
SCHEMBL16473244 0.70 TGFBR1 (0.50) ABL1TGFBR1TGFBR2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9878992-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-01-30 — — US disclosed
US-20170096409-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use MIDCAP FINANCIAL TRUST 2017-04-06 — — US disclosed
US-9145433-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-09-29 — — US disclosed
US-20140107073-A1 GDF-8 Inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2014-04-17 — — 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-20140107073-A1 GDF-8 Inhibitors MSTN, MYOF, CXCL8 KMT2A 4190/4885RAB9A 900/4885MAPT 4198/4885
US-20170096409-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use TGFBR1, TGFBR2, ACVR1 KMT2A 3459/4885RAB9A 3860/4885MAPT 4200/4885

“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.

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