SCHEMBL17836741

SCHEMBL17836741

CC(C)(C)[Si](C)(C)Oc1ccc(Br)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.46
CA1 P00915 4/20 0.46
CA9 Q16790 4/20 0.46
PREP P48147 4/20 0.38
CHRNA3 P32297 1/20 0.33
MAOB P27338 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
AHR P35869 1/20 0.31
MCHR1 Q99705 1/20 0.31
HSP90AB1 P08238 2/20 0.31
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL14992681 0.86 CA12 (0.46) CA12CA1CA9PREPAHR
SCHEMBL24455832 0.81 CA12 (0.45) CA12CA1CA9PREPMEN1
SCHEMBL29653234 0.81 CA12 (0.45) CA12CA1CA9PREPMEN1
SCHEMBL20535255 0.81 CA12 (0.45) CA12CA1CA9PREPHSP90AB1
SCHEMBL3690504 0.80 CA12 (0.47) CA12CA1CA9PREPCHRNA3
SCHEMBL1828057 0.80 CA12 (0.47) CA12CA1CA9PREPHSP90AB1
SCHEMBL7045640 0.79 CA12 (0.46) CA12CA1CA9PREPMEN1
SCHEMBL22128458 0.79 CA12 (0.46) CA12CA1CA9PREPHSP90AB1
SCHEMBL28422272 0.79 CA12 (0.46) CA12CA1CA9PREPMCHR1
SCHEMBL2114690 0.78 CA12 (0.43) CA12CA1CA9PREPHSP90AB1

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260055094-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2026-02-26 US disclosed
EP-4691553-A2 FXR (NR1H4) MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2026-02-11 EP disclosed
US-12358903-B2 FXR (NR1H4) modulating compounds GILEAD SCIENCES, INC. (US) 2025-07-15 US disclosed
EP-4534536-A1 FXR (NR1H4) MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2025-04-09 EP disclosed
US-20250026744-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2025-01-23 US disclosed
CN-113302190-B FXR (NR 1H 4) modulating compounds 吉利德科学公司 2024-10-18 CN disclosed
US-20240335442-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS UNIVERSIDADE FEDERAL DO RIO DE JANEIRO – UFRJ (BR) 2024-10-10 US disclosed
EP-4089072-B1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2024-08-28 EP disclosed
EP-4382100-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS Eurofarma Laboratórios S.A. (BR) 2024-06-12 EP disclosed
CN-118076348-A N-acylhydrazone compounds capable of inhibiting NAV 1.7 and/or NAV 1.8, methods of making, compositions, uses, methods of treatment and kits using the same 欧罗法玛实验室股份公司 2024-05-24 CN disclosed
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 US disclosed
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 US disclosed
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 US disclosed
US-20170355693-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-12-14 US disclosed
EP-3233831-A1 NOVEL FXR (NR1H4) MODULATING COMPOUNDS Gilead Sciences, Inc. (US) 2017-10-25 EP disclosed
US-20170298068-A1 NOVEL FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2017-10-19 US disclosed
WO-2017128896-A1 FXR AGONIST AND PREPARATION METHOD AND USE THEREOF 江苏豪森药业集团有限公司 2017-08-03 WO disclosed
WO-2016096116-A1 NOVEL FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2016-06-23 WO disclosed
WO-2016096116-A1 NOVEL FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2016-06-23 WO disclosed
EP-3034499-A1 Novel FXR (NR1H4) modulating compounds Gilead Sciences, Inc. (US) 2016-06-22 EP 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 (7 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-20250026744-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4742/4885CA1 4536/4885CA9 4854/4885
US-20170298068-A1 NOVEL FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4698/4885CA1 4488/4885CA9 4843/4885
US-12358903-B2 FXR (NR1H4) modulating compounds NR1H4, NR1H2, NR1H3 CA12 4661/4885CA1 4307/4885CA9 4851/4885
US-20240335442-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS SCN1A, SCN7A, SCN8A CA12 2541/4885CA1 699/4885CA9 1184/4885
US-20170355685-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4661/4885CA1 4307/4885CA9 4851/4885
US-20260055094-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4265/4885CA1 3288/4885CA9 4154/4885
US-20170355693-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 CA12 4661/4885CA1 4307/4885CA9 4851/4885

“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.