SCHEMBL19806362

SCHEMBL19806362

Cc1cc(-c2n[nH]cc2-c2ccc3nccn3c2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 14/20 0.47
GRM2 Q14416 1/20 0.46
PDE4A P27815 1/20 0.43
PDE3A Q14432 1/20 0.43
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
NFKB1 P19838 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TGFBR2 P37173 1/20 0.41
DYRK1A Q13627 2/20 0.40
CYP1A2 P05177 1/20 0.40
METAP2 P50579 1/20 0.40

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
SCHEMBL19806480 0.86 TGFBR1 (0.60) TGFBR1GRM2DYRK1ACYP1A2METAP2
SCHEMBL19806337 0.83 TGFBR1 (0.51) TGFBR1PDE4APDE3ACYP3A4HPGD
SCHEMBL13874033 0.82 TGFBR1 (0.48) TGFBR1PDE4APDE3ACYP3A4HPGD
SCHEMBL15638144 0.82 TGFBR1 (0.59) TGFBR1GRM2PDE4APDE3ACYP3A4
SCHEMBL19806559 0.81 DYRK1A (0.46) TGFBR1GRM2PDE4APDE3ACYP3A4
SCHEMBL18041976 0.78 TGFBR1 (0.51) TGFBR1GRM2PDE4APDE3ACYP3A4
SCHEMBL29677080 0.78 TGFBR1 (0.51) TGFBR1GRM2PDE4APDE3ACYP3A4
SCHEMBL19806364 0.78 TGFBR1 (0.45) TGFBR1GRM2PDE4APDE3ACYP3A4
SCHEMBL8948378 0.78 TGFBR1 (0.50) TGFBR1PDE4APDE3ACYP3A4HPGD
SCHEMBL19806383 0.77 TGFBR1 (0.45) TGFBR1GRM2TGFBR2DYRK1A

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 1/4885GRM2 1261/4885PDE4A 2211/4885

“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.