SCHEMBL24809031

SCHEMBL24809031

Cc1cc(N)c(F)cc1Oc1cnc2c(c1)ncn2C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.40
DOT1L Q8TEK3 1/20 0.35
DYRK1A Q13627 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30
JAK3 P52333 1/20 0.30
MAPK14 Q16539 1/20 0.30

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
SCHEMBL30051153 0.86 GRM5 (0.39) GRM5DOT1L
SCHEMBL24807716 0.82 DPP4 (0.32)
SCHEMBL24173326 0.81 KMT2A (0.44) GRM5
SCHEMBL30050598 0.80 GRM5 (0.39) GRM5DOT1L
SCHEMBL30051312 0.80 GRM5 (0.44) GRM5DOT1LDYRK1AADORA2AADORA1
SCHEMBL23959239 0.80 GRM5 (0.44) GRM5DOT1LDYRK1AADORA2AADORA1
SCHEMBL30050420 0.79 GRM5 (0.42) GRM5DOT1LDYRK1A
SCHEMBL24807701 0.79 GRM5 (0.42) GRM5DOT1LDYRK1A
SCHEMBL24810325 0.76 GRM5 (0.41) GRM5DOT1LDYRK1A
SCHEMBL24167925 0.73 MAP4K4 (0.42) GRM5

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-20230041385-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2023-02-09 US disclosed
WO-2022269531-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2022-12-29 WO disclosed
WO-2022269531-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2022-12-29 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-20230041385-A1 HER2 MUTATION INHIBITORS ERBB2, EGFR, ERBB3 GRM5 2106/4885DOT1L 1501/4885DYRK1A 166/4885

“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.