SCHEMBL19862027

SCHEMBL19862027

CC1=NOCc2cc(-c3ccc(F)cc3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
CYP11B2 P19099 2/20 0.39
CYP17A1 P05093 2/20 0.37
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
UGCG Q16739 9/20 0.36
PTGS2 P35354 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
HRH3 Q9Y5N1 1/20 0.33
CYP11B1 P15538 1/20 0.33
KDM1A O60341 1/20 0.33
PGR P06401 1/20 0.33

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
SCHEMBL18070681 0.81 CYP3A4 (0.40) CYP3A4CYP11B2CYP17A1UGCGHRH3
SCHEMBL21123280 0.81 CYP3A4 (0.38) CYP3A4CYP11B2CYP17A1UGCGPTGS2
SCHEMBL18069869 0.77 UGCG (0.45) CYP3A4CYP11B2UGCG
SCHEMBL18070696 0.76 UGCG (0.47) UGCGNPC1MAPTRAB9A
SCHEMBL19862022 0.73 MAPK10 (0.46) CYP3A4CYP11B2CYP17A1MAPTHRH3
SCHEMBL19862036 0.73 PRF1 (0.43) UGCGPGR
SCHEMBL19862033 0.71 CYP3A4 (0.40) CYP3A4CYP11B2CYP17A1UGCGMAPT
SCHEMBL1482704 0.68 CYP3A4 (0.51) CYP3A4CYP11B2CYP17A1HRH3CYP11B1
SCHEMBL21122856 0.68 CYP3A4 (0.36) CYP3A4CYP11B2CYP17A1PTGS2NPC1
SCHEMBL19862020 0.68 UGCG (0.35) CYP3A4PDE3BPDE3AUGCGNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759769-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARMECEUTICAL INC (US) 2020-09-01 US disclosed
US-20190248754-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMECEUTICAL INC (US) 2019-08-15 US disclosed
US-10227312-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARMACEUTICAL INC. (US) 2019-03-12 US disclosed
US-20180044302-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2018-02-15 US disclosed
US-20180044302-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2018-02-15 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 (4 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-10759769-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CYP3A4 3339/4885CYP11B2 1270/4885CYP17A1 713/4885
US-20180044302-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CYP3A4 3339/4885CYP11B2 1270/4885CYP17A1 713/4885
US-20190248754-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 CYP3A4 3339/4885CYP11B2 1270/4885CYP17A1 713/4885
US-10227312-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 CYP3A4 3339/4885CYP11B2 1270/4885CYP17A1 713/4885

“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.