SCHEMBL19973613

SCHEMBL19973613

Cc1cc(NC(=O)c2cccc3c2OCC[C@@H]3NC(=O)O)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.43
TRPV1 Q8NER1 6/20 0.41
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
TP53 P04637 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.40
PTGES O14684 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
CRACR2A Q9BSW2 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL19973614 1.00 HTR2B (0.43) HTR2BTRPV1NPC1RAB9ATP53
SCHEMBL19973586 0.92 TP53 (0.46) TRPV1NPC1RAB9ATP53SMN1; SMN2
SCHEMBL19973432 0.92 TP53 (0.46) TRPV1NPC1RAB9ATP53SMN1; SMN2
SCHEMBL19973433 0.92 TP53 (0.46) TRPV1NPC1RAB9ATP53SMN1; SMN2
SCHEMBL21189284 0.91 APOB (0.42) HTR2BTRPV1NPC1RAB9ATP53
Hydrochloric Acid SCHEMBL19973580 0.91 TP53 (0.46) TRPV1NPC1RAB9ATP53SMN1; SMN2
Hydrochloric Acid SCHEMBL19973574 0.91 TP53 (0.46) TRPV1NPC1RAB9ATP53SMN1; SMN2
SCHEMBL19973437 0.89 FADS1 (0.48) NPC1RAB9ATP53SMN1; SMN2HPGD
SCHEMBL19973438 0.89 FADS1 (0.48) NPC1RAB9ATP53SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL19973479 0.88 FADS1 (0.47) NPC1RAB9ASMN1; SMN2HPGDPTGES

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-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
WO-2018052967-A1 SUBSTITUTED CHROMANE-8-CARBOXAMIDE COMPOUNDS AND ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA, INC. (US) 2018-03-22 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 (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 HTR2B 2367/4885TRPV1 3647/4885NPC1 983/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS HTR2B 2367/4885TRPV1 3647/4885NPC1 983/4885

“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.