SCHEMBL31435992

SCHEMBL31435992

COc1nn(C2CCN(C(=O)OC(C)(C)C)C2)cc1I

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.44
EGFR P00533 3/20 0.41
ABL1 P00519 2/20 0.41
ABL2 P42684 2/20 0.41
CTSD P07339 1/20 0.41
CTSE P14091 1/20 0.41
BACE1 P56817 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PIK3CA P42336 3/20 0.40
PDE4B Q07343 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
PIK3CD O00329 4/20 0.39
USP30 Q70CQ3 3/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 0.38

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
SCHEMBL31435965 0.93 FPR2 (0.40) SRCEGFRABL1ABL2CTSD
SCHEMBL31435997 0.93 ALDH1A1 (0.45) CTSDCTSEBACE1ALDH1A1GPR119
SCHEMBL30365373 0.91 PDE4B (0.38) SRCCTSDCTSEBACE1ALDH1A1
SCHEMBL31435966 0.89 HCAR1 (0.46) ABL1CTSDCTSEBACE1ALDH1A1
SCHEMBL31435934 0.81 IRAK4 (0.44) ALDH1A1GPR119IRAK4DDB1CRBN
SCHEMBL27253665 0.80 BACE1 (0.50) SRCCTSDCTSEBACE1ALDH1A1
SCHEMBL28766351 0.80 SRC (0.43) SRCEGFRALDH1A1GPR119USP30
SCHEMBL28766353 0.80 SRC (0.43) SRCEGFRALDH1A1GPR119USP30
SCHEMBL2386252 0.79 ALDH1A1 (0.45) CTSDCTSEBACE1ALDH1A1GPR119
SCHEMBL22245129 0.78 SRC (0.40) SRCEGFRABL1ABL2CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250019378-A1 PYRROLE[2,3-B]PYRIDINE DERIVATIVES AS TYRO3 INHIBITORS HALIA THERAPEUTICS INC (US) 2025-01-16 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 (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-20250019378-A1 PYRROLE[2,3-B]PYRIDINE DERIVATIVES AS TYRO3 INHIBITORS TYRO3, TH, TYR SRC 23/4885EGFR 853/4885ABL1 128/4885

“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.