SCHEMBL898733

SCHEMBL898733

COC(=O)Cc1cc(OC)ccc1Br

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.52
ALDH1A1 P00352 2/20 0.52
KDM4E B2RXH2 1/20 0.52
HSD17B10 Q99714 1/20 0.49
AKR1C3 P42330 2/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
HDAC1 Q13547 1/20 0.44
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGS1 P23219 1/20 0.41
AKR1C2 P52895 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 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
SCHEMBL29853520 1.00 HPGD (0.52) HPGDALDH1A1KDM4EHSD17B10AKR1C3
SCHEMBL30046118 0.88 ALDH1A1 (0.54) HPGDALDH1A1KDM4EHSD17B10AKR1C3
SCHEMBL2436724 0.88 ALDH1A1 (0.54) HPGDALDH1A1KDM4EHSD17B10AKR1C3
SCHEMBL16930305 0.86 HTT (0.44) HPGDALDH1A1KDM4ENPC1MAPT
SCHEMBL2742615 0.85 HSD17B10 (0.68) HPGDKDM4EHSD17B10AKR1C3MAPT
SCHEMBL26810800 0.84 ALDH1A1 (0.39) HPGDALDH1A1KDM4EHSD17B10AKR1C3
SCHEMBL16294203 0.84 POLB (0.48) HPGDALDH1A1KDM4EHSD17B10HDAC1
Bromide SCHEMBL29853696 0.83 HSD17B10 (0.66) HPGDKDM4EHSD17B10AKR1C3MAPT
SCHEMBL10624636 0.83 HSD17B10 (0.49) HPGDHSD17B10AKR1C3HDAC1NPC1
SCHEMBL1097014 0.83 HSD17B10 (0.49) HPGDALDH1A1KDM4EHSD17B10AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4712958-A2 USE OF UROLITHIN DERIVATIVES IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS Vandria SA (CH) 2026-03-25 EP disclosed
US-20260070920-A1 N-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2026-03-12 US disclosed
EP-4169925-B1 PROCESS TO MAKE N-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE DERIVATIVES NOVARTIS AG (CH) 2025-11-19 EP disclosed
US-12473269-B2 Urolithin derivatives and methods of use thereof VANDRIA SA (CH) 2025-11-18 US disclosed
US-12358884-B2 Urolithin derivatives and methods of use thereof VANDRIA SA (CH) 2025-07-15 US disclosed
US-12351567-B2 Urolithin derivatives and methods of use thereof VANDRIA SA (CH) 2025-07-08 US disclosed
US-12331060-B2 N-substituted tetrahydrothienopyridine derivatives and uses thereof NOVARTIS AG (CH) 2025-06-17 US disclosed
US-20240424006-A1 USE OF UROLITHIN DERIVATIVES IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS VANDRIA SA (CH) 2024-12-26 US disclosed
WO-2024255412-A1 SPIRO HETEROCYCLIC COMPOUND AND USE THEREOF 广州必贝特医药股份有限公司 2024-12-19 WO disclosed
WO-2024236367-A2 USE OF UROLITHIN DERIVATIVES IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS VANDRIA SA (CH) 2024-11-21 WO disclosed
EP-3345903-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed
US-20160340308-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-24 US disclosed
US-9440922-B2 Tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-09-13 US disclosed
EP-2441753-B1 TETRACYCLIC COMPOUND CHUGAI PHARMACEUTICAL CO LTD (JP) 2016-03-30 EP disclosed
EP-2975024-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-01-20 EP disclosed
US-9126931-B2 Tetracyclic compound CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-09-08 US disclosed
US-20150150845-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-06-04 US disclosed
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed
US-20120083488-A1 TETRACYCLIC COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA 2012-04-05 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 (9 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-20240424006-A1 USE OF UROLITHIN DERIVATIVES IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS UBQLN2, SOD1, UBQLN1 HPGD 2759/4885ALDH1A1 1601/4885KDM4E 4157/4885
US-12358884-B2 Urolithin derivatives and methods of use thereof NLN, UQCRC2, TUFM HPGD 499/4885ALDH1A1 851/4885KDM4E 4333/4885
US-20120083488-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HPGD 4633/4885ALDH1A1 1165/4885KDM4E 903/4885
US-12331060-B2 N-substituted tetrahydrothienopyridine derivatives and uses thereof TPMT, NNMT, NLN HPGD 1055/4885ALDH1A1 1472/4885KDM4E 3338/4885
US-12351567-B2 Urolithin derivatives and methods of use thereof NLN, UQCRC2, TUFM HPGD 499/4885ALDH1A1 851/4885KDM4E 4333/4885
US-20160340308-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HPGD 4633/4885ALDH1A1 1165/4885KDM4E 903/4885
US-12473269-B2 Urolithin derivatives and methods of use thereof NLN, UQCRC2, TUFM HPGD 499/4885ALDH1A1 851/4885KDM4E 4333/4885
US-20260070920-A1 N-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE DERIVATIVES AND USES THEREOF CCR3, SCN1B, NR3C1 HPGD 3292/4885ALDH1A1 1462/4885KDM4E 3018/4885
US-20150150845-A1 TETRACYCLIC COMPOUND ALK, TTR, ACVR1 HPGD 4633/4885ALDH1A1 1165/4885KDM4E 903/4885

“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.