SCHEMBL18070541

SCHEMBL18070541

CC(=O)c1cc(-c2ccc(F)cc2)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
GFER P55789 1/20 0.53
KMT2A Q03164 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
IKBKB O14920 3/20 0.50
KEAP1 Q14145 1/20 0.50
HDAC2 Q92769 13/20 0.47
HDAC1 Q13547 11/20 0.45
HDAC3 O15379 10/20 0.45
CHUK O15111 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
BCL2L1 Q07817 1/20 0.41
BAD Q92934 1/20 0.41

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
SCHEMBL3618305 0.89 KMT2A (0.65) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL3786945 0.85 KMT2A (0.57) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL9665493 0.85 KEAP1 (0.68) KDM4EGFERKMT2ARXFP1KEAP1
SCHEMBL29467969 0.85 KEAP1 (0.68) KDM4EGFERKMT2ARXFP1KEAP1
SCHEMBL3876452 0.85 TAAR1 (0.51) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL2789012 0.84 KMT2A (0.78) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL5308529 0.84 IKBKB (0.71) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL3792022 0.84 IKBKB (0.71) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL31570070 0.84 IKBKB (0.71) KDM4EGFERKMT2ARXFP1IKBKB
SCHEMBL1015993 0.81 KDM4E (0.55) KDM4EGFERKMT2ARXFP1IKBKB

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 7 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
EP-3268355-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARM INC (US) 2019-06-12 EP 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
WO-2016145153-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-09-15 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-10759769-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 KDM4E 4557/4885GFER 2194/4885KMT2A 4177/4885
US-20180044302-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 KDM4E 4557/4885GFER 2194/4885KMT2A 4177/4885
US-20190248754-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THE TREATMENT OF DISEASES GBA1, UGCG, GBA2 KDM4E 4557/4885GFER 2194/4885KMT2A 4177/4885
US-10227312-B2 Glucosylceramide synthase inhibitors for the treatment of diseases GBA1, UGCG, GBA2 KDM4E 4557/4885GFER 2194/4885KMT2A 4177/4885

“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.