SCHEMBL30294556

SCHEMBL30294556

COc1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Nc2cccc(C(F)(F)F)c2C)c(C)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ LCK P06239 8/20 0.46
▸ SORT1 Q99523 1/20 0.42
▸ NPC1 O15118 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ TAS2R14 Q9NYV8 1/20 0.40
▸ MAPK14 Q16539 5/20 0.40
▸ SCN10A Q9Y5Y9 1/20 0.40
▸ MAPK3 P27361 4/20 0.39
▸ KDR P35968 4/20 0.39
▸ JAK3 P52333 3/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ LIPE Q05469 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL22853062 1.00 DHODH (0.47) DHODHHDAC6LCKSORT1NPC1
SCHEMBL22853060 0.90 TOP1 (0.47) DHODHSORT1NPC1MAPT
SCHEMBL30294610 0.90 TOP1 (0.47) DHODHSORT1NPC1MAPT
SCHEMBL22853145 0.88 SCN10A (0.41) DHODHSORT1NPC1MAPTSCN10A
SCHEMBL30294498 0.88 SCN10A (0.41) DHODHSORT1NPC1MAPTSCN10A
SCHEMBL30294778 0.86 SORT1 (0.46) DHODHLCKSORT1NPC1MAPT
SCHEMBL22853203 0.86 SORT1 (0.46) DHODHLCKSORT1NPC1MAPT
SCHEMBL22833774 0.84 SCN10A (0.41) DHODHSORT1NPC1MAPTSCN10A
SCHEMBL29382605 0.84 SCN10A (0.41) DHODHSORT1NPC1MAPTSCN10A
SCHEMBL22853204 0.83 SMN1; SMN2 (0.43) SORT1NPC1MAPTSCN10AMAPK3

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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-06 — — 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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS SCN8A, SCN1A, SCN1B DHODH 1951/4885HDAC6 428/4885LCK 1036/4885

“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.

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