SCHEMBL30669883

SCHEMBL30669883

[2H]c1cnc2[nH]ccc2c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.52
PRKCI P41743 4/20 0.44
AXL P30530 2/20 0.44
TTBK1 Q5TCY1 3/20 0.40
TTBK2 Q6IQ55 3/20 0.40
AURKB Q96GD4 2/20 0.40
CCNK O75909 2/20 0.40
CDK12 Q9NYV4 2/20 0.40
JAK2 O60674 2/20 0.40
JAK3 P52333 2/20 0.40
IKBKB O14920 1/20 0.40
CHUK O15111 1/20 0.40
DAPK3 O43293 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
PAK4 O96013 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
IGF1R P08069 1/20 0.40
FGFR1 P11362 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
SCHEMBL29424797 0.84 BRD4 (0.60) BRD4PRKCIAXLTTBK1TTBK2
SCHEMBL298491 0.84 BRD4 (0.60) BRD4PRKCIAXLTTBK1TTBK2
SCHEMBL30669881 0.77 PRKCI (0.49) BRD4PRKCIAXLAURKBCCNK
SCHEMBL10125070 0.71 BRD4 (0.66) BRD4PRKCIAURKBCCNKCDK12
SCHEMBL858602 0.71 BRD4 (0.62) BRD4PRKCIAURKBCCNKCDK12
SCHEMBL18680897 0.70 AXL (0.50) BRD4PRKCIAXLTTBK1TTBK2
SCHEMBL2992617 0.70 NUDT1 (0.55) BRD4PRKCIAXLTTBK1TTBK2
SCHEMBL12605521 0.70 CCNK (0.51) BRD4PRKCIAXLAURKBCCNK
SCHEMBL858227 0.69 BRD4 (0.75) BRD4PRKCIAURKBCCNKCDK12
SCHEMBL12605536 0.69 CCNB2 (0.51) BRD4TTBK1TTBK2AURKBJAK2

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-20230339978-A1 COMPOUNDS FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISORDERS 1ST Biotherapeutics, Inc. (KR) 2023-10-26 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-20230339978-A1 COMPOUNDS FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISORDERS NLN, BDNF, NEFM BRD4 4007/4885PRKCI 2174/4885AXL 4850/4885

“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.