SCHEMBL21189308

SCHEMBL21189308

CC(C)(C)OC(=O)N1CCC(COC(=O)N[C@H]2CCOc3c(C(=O)Nc4ccc(F)c(Cl)c4)ccc(F)c32)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.49
GPR35 Q9HC97 2/20 0.49
GPR55 Q9Y2T6 2/20 0.49
CNR1 P21554 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
LMNA P02545 3/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 3/20 0.41
THRB P10828 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL21189492 0.91 CHRM3 (0.40) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL19973909 0.90 IDO1 (0.40) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL19973907 0.90 IDO1 (0.40) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL21189310 0.89 MAPT (0.40) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL21189385 0.88 CHRM3 (0.38) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL19973963 0.86 MCHR1 (0.40) MAPTLMNAMEN1KMT2ATP53
SCHEMBL21189186 0.86 MAPT (0.44) MAPTGPR35GPR55CNR1NPSR1
SCHEMBL21189382 0.84 KMT2A (0.39) MAPTLMNAMEN1KMT2ATP53
SCHEMBL19973622 0.84 CHRM1 (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL19973889 0.84 CHRM1 (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2

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 MAPT 3165/4885GPR35 1322/4885GPR55 1817/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS MAPT 3165/4885GPR35 1322/4885GPR55 1817/4885

“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.