SCHEMBL20178573

SCHEMBL20178573

CCc1cccc(NC(=O)NS(=O)(=O)N(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MEN1 O00255 2/20 0.53
RAB9A P51151 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 1/20 0.53
ALOX15 P16050 1/20 0.53
IDH1 O75874 1/20 0.49
HDAC3 O15379 2/20 0.49
HDAC4 P56524 2/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC7 Q8WUI4 2/20 0.49
HDAC2 Q92769 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
HDAC9 Q9UKV0 2/20 0.49
HDAC5 Q9UQL6 2/20 0.49

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
SCHEMBL20118992 0.81 TSHR (0.56) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14405803 0.81 MAPT (0.62) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14194063 0.79 HPGD (0.65) MAPTMEN1KMT2AHPGDPOLB
SCHEMBL20178589 0.78 SMN1; SMN2 (0.60) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL20173764 0.78 CA2 (0.59) MEN1KMT2AHTT
SCHEMBL20178601 0.77 KAT6A (0.54) SMN1; SMN2MEN1RAB9AKMT2ANPC1
SCHEMBL24211435 0.76 MAPT (0.61) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL4104375 0.76 RAB9A (0.71) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14368010 0.76 MAPT (0.61) MAPTSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL15601823 0.76 MAPT (0.54) MAPTSMN1; SMN2MEN1RAB9AKMT2A

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-10597391-B2 Urea-containing isoxazole derivatives as FXR agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2020-03-24 US disclosed
US-20180141941-A1 UREA-CONTAINING ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2018-05-24 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-20180141941-A1 UREA-CONTAINING ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF NR1H4, FXR1, SLC10A1 MAPT 2493/4885SMN1; SMN2 4665/4885MEN1 4363/4885
US-10597391-B2 Urea-containing isoxazole derivatives as FXR agonists and methods of use thereof NR1H4, FXR1, SLC10A1 MAPT 2493/4885SMN1; SMN2 4665/4885MEN1 4363/4885

“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.