SCHEMBL21189265

SCHEMBL21189265

COC(=O)N[C@H]1CCOc2c(C(=O)NCc3cccc(F)c3)cccc21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.44
TP53 P04637 2/20 0.42
PDE10A Q9Y233 1/20 0.41
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 4/20 0.39
TSHR P16473 1/20 0.39
ROCK2 O75116 2/20 0.39
ROCK1 Q13464 2/20 0.39
ALDH1A1 P00352 2/20 0.39
P2RX7 Q99572 1/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 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
SCHEMBL21189490 0.90 KMT2A (0.44) TRPV1TP53LMNAHPGDALDH1A1
SCHEMBL19973428 0.89 TRPV1 (0.44) TRPV1LMNATHRBHPGDTSHR
SCHEMBL19973427 0.89 TRPV1 (0.44) TRPV1LMNATHRBHPGDTSHR
SCHEMBL21189350 0.81 TRPV1 (0.38) TRPV1TP53TSHRALDH1A1MAPT
SCHEMBL21189281 0.79 LMNA (0.41) TRPV1TP53LMNATSHRALDH1A1
SCHEMBL19973605 0.79 KMT2A (0.49) TRPV1TP53LMNAHPGDALDH1A1
SCHEMBL19973607 0.79 KMT2A (0.49) TRPV1TP53LMNAHPGDALDH1A1
SCHEMBL21189267 0.78 AKR1C3 (0.38) TRPV1TP53HPGDALDH1A1
SCHEMBL19973644 0.77 TRPV1 (0.38) TRPV1KDM4E
SCHEMBL19973646 0.77 TRPV1 (0.38) TRPV1KDM4E

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 TRPV1 3647/4885TP53 166/4885PDE10A 3540/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS TRPV1 3647/4885TP53 166/4885PDE10A 3540/4885

“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.