SCHEMBL21189263

SCHEMBL21189263

O=C(N[C@@H]1CCOc2c(C(=O)Nc3ccc(F)c(F)c3)cccc21)OCc1ccncc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.39
ROCK2 O75116 1/20 0.37
TP53 P04637 2/20 0.36
TRPV1 Q8NER1 3/20 0.36
P2RX7 Q99572 1/20 0.35
POLB P06746 1/20 0.35
AURKA O14965 1/20 0.35
AURKB Q96GD4 1/20 0.35
RAB9A P51151 2/20 0.35
GRM4 Q14833 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAOB P27338 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL21189207 1.00 NAMPT (0.39) NAMPTROCK2TP53TRPV1P2RX7
SCHEMBL19973602 1.00 NAMPT (0.39) NAMPTROCK2TP53TRPV1P2RX7
SCHEMBL21189329 0.91 MEN1 (0.42) NAMPTROCK2P2RX7POLBGRM4
SCHEMBL21189487 0.91 MEN1 (0.42) NAMPTROCK2P2RX7POLBGRM4
SCHEMBL21189337 0.89 P2RX7 (0.39) TP53TRPV1P2RX7GRM4
SCHEMBL21189250 0.89 GRM4 (0.36) TP53TRPV1P2RX7RAB9AGRM4
SCHEMBL21189272 0.87 GRM4 (0.36) TP53TRPV1P2RX7RAB9AGRM4
SCHEMBL21189264 0.87 NPC1 (0.44) TP53P2RX7POLBRAB9AGRM4
SCHEMBL19973466 0.87 NPC1 (0.44) TP53P2RX7POLBRAB9AGRM4
SCHEMBL21189330 0.87 NPC1 (0.44) TP53P2RX7POLBRAB9AGRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same ARBUTUS BIOPHARMA CORPORATION (CA) 2021-05-11 US disclosed
US-20190225593-A1 SUBSTITUTED CHROMANE-8-CARBOXAMIDE COMPOUNDS AND ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (CA) 2019-07-25 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 (2 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-20190225593-A1 SUBSTITUTED CHROMANE-8-CARBOXAMIDE COMPOUNDS AND ANALOGUES THEREOF, AND METHODS USING SAME CBX8, HAVCR2, HCCS NAMPT 558/4885ROCK2 3119/4885TP53 166/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS NAMPT 558/4885ROCK2 3119/4885TP53 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.