SCHEMBL19806573

SCHEMBL19806573

Cc1nc(-c2cc[nH]n2)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 18/20 0.36
TGFBR2 P37173 5/20 0.36
MAPK14 Q16539 6/20 0.35
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
NPC1 O15118 1/20 0.31
CASP3 P42574 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 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
SCHEMBL20161346 0.74 TGFBR1 (0.34) TGFBR1RAB9A
SCHEMBL1673128 0.73
SCHEMBL19806300 0.71 PIM1 (0.34) PIM1SMN1; SMN2
SCHEMBL15326962 0.71 CCR1 (0.64) TGFBR1MAPK14
SCHEMBL29590093 0.71 CCR1 (0.64) TGFBR1MAPK14
SCHEMBL8202122 0.70 DAPK3 (0.47) TGFBR1PIM1NPC1CASP3RAB9A
SCHEMBL2458453 0.70 CCR1 (0.41) RAB9ASMN1; SMN2
SCHEMBL20447113 0.69 AAK1 (0.45) TGFBR1MAPK14NPC1RAB9A
SCHEMBL20090330 0.69 IDH1 (0.31)
Hydrochloric Acid SCHEMBL31178133 0.69 DAPK3 (0.46) TGFBR1PIM1NPC1CASP3RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2019-09-26 US disclosed
US-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2019-09-26 US disclosed
WO-2018017633-A1 TGF Beta RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-25 WO 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 (1 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-20190292179-A1 TGF Beta RECEPTOR ANTAGONISTS TGFBR1, TGFBR2, TGFB1 TGFBR1 1/4885TGFBR2 2/4885MAPK14 2427/4885

“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.