SCHEMBL19280465

SCHEMBL19280465

Cc1cc(I)n2ncnc(N)c12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.35
ACVRL1 P37023 9/20 0.35
RET P07949 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KDR P35968 1/20 0.33
FGFR1 P11362 1/20 0.32
FGFR3 P22607 1/20 0.32
EGLN2 Q96KS0 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
SCHEMBL66503 0.81 ALDH1A1 (0.43) PIK3CDACVRL1RETALDH1A1KDR
SCHEMBL19280434 0.79 ALDH1A1 (0.33) ALDH1A1
SCHEMBL19698013 0.79 PIK3CD (0.35) PIK3CDACVRL1RETALDH1A1KDR
SCHEMBL65572 0.76 ACVRL1 (0.45) PIK3CDACVRL1
SCHEMBL26690322 0.76 ACVRL1 (0.52) PIK3CDACVRL1RETKDR
SCHEMBL26505471 0.76 PIK3CD (0.34) PIK3CDACVRL1RETALDH1A1KDR
SCHEMBL65394 0.75 ACVRL1 (0.50) ACVRL1FGFR1FGFR3
SCHEMBL65734 0.75 PIK3CD (0.36) PIK3CDACVRL1RETKDR
SCHEMBL21199005 0.75 PIK3CD (0.42) PIK3CD
SCHEMBL64689 0.73 ACVRL1 (0.55) PIK3CDACVRL1RETKDRFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3209664-B1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-06-03 EP disclosed
EP-3209664-B1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-06-03 EP disclosed
US-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
US-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
US-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
EP-3209664-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS Bristol-Myers Squibb Company (US) 2017-08-30 EP 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-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS PIK3R3, JAK2, JAK3 PIK3CD 14/4885ACVRL1 2053/4885RET 332/4885

“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.