SCHEMBL21363669

SCHEMBL21363669

CC(C)(CCC(C)(C)c1ccccn1)c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AHR P35869 1/20 0.38
CHRM2 P08172 1/20 0.38
HDAC6 Q9UBN7 4/20 0.38
CETP P11597 1/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
AGTR1 P30556 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP17A1 P05093 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
SCHEMBL21413937 0.86 CHRM2 (0.49) SMN1; SMN2L3MBTL1CHRM2CETPKDM4E
SCHEMBL24065677 0.83 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1AHRCHRM2RAB9A
SCHEMBL19441058 0.79 TAAR1 (0.50) SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL19879719 0.76 CYP19A1 (0.41) SMN1; SMN2L3MBTL1CHRM2
SCHEMBL18427298 0.75 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1CHRM2KDM4E
SCHEMBL19916767 0.75 ALDH1A1 (0.36) SMN1; SMN2L3MBTL1AHRCHRM2HDAC6
SCHEMBL12803075 0.74 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1CHRM2HDAC6
SCHEMBL25054047 0.74 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1AHRCHRM2RAB9A
SCHEMBL13077728 0.74 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1AHRCHRM2MEN1
SCHEMBL27800482 0.74 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1AHRCHRM2KDM4E

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-10710994-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2020-07-14 US disclosed
US-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 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-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 SMN1; SMN2 1161/4885L3MBTL1 3669/4885AHR 417/4885
US-10710994-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 SMN1; SMN2 1161/4885L3MBTL1 3669/4885AHR 417/4885

“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.