SCHEMBL16595182

SCHEMBL16595182

COC(=O)C(F)(F)C1Cc2cc(Cl)c(Cl)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
MCHR1 Q99705 1/20 0.36
NR1H2 P55055 11/20 0.35
NR1H3 Q13133 11/20 0.35
SLC6A3 Q01959 2/20 0.34
SLC6A4 P31645 1/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPK1 P28482 1/20 0.32
GPR35 Q9HC97 1/20 0.32

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
SCHEMBL16595289 0.85 NR1H2 (0.41) SMN1; SMN2NR1H2NR1H3
SCHEMBL16595778 0.80 HTR1D (0.36) NR1H2NR1H3SLC6A3SLC6A4
SCHEMBL17996474 0.80 KCNN4 (0.42) MEN1MAPTKMT2AMAPK1
SCHEMBL16595179 0.80 PTGS2 (0.33)
SCHEMBL29992013 0.70 KMT2A (0.47) SMN1; SMN2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL16595184 0.68 TSHR (0.35) SLC6A3SLC6A4
SCHEMBL16595183 0.66 SLC6A3 (0.44) SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL10812638 0.64 KMT2A (0.38) SMN1; SMN2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL3464187 0.63 CNR2 (0.33) MAPT
SCHEMBL21557672 0.61 KMT2A (0.42) SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10927092-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARM INC (US) 2021-02-23 US disclosed
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARM INC (US) 2019-08-29 US disclosed
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases BIOMARIN PHARMACEUTICAL INC. (US) 2019-03-12 US disclosed
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2016-08-11 US disclosed
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2016-08-11 US disclosed
WO-2015042397-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2015-03-26 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 (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-10927092-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 SMN1; SMN2 1269/4885MCHR1 4367/4885NR1H2 495/4885
US-20160229830-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 SMN1; SMN2 1269/4885MCHR1 4367/4885NR1H2 495/4885
US-10227323-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 SMN1; SMN2 1269/4885MCHR1 4367/4885NR1H2 495/4885
US-20190263775-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 SMN1; SMN2 1269/4885MCHR1 4367/4885NR1H2 495/4885

“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.