SCHEMBL44905

SCHEMBL44905

N[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 14/20 0.58
HDAC3 O15379 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC2 Q92769 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
CYP2C9 P11712 3/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP1A2 P05177 2/20 0.54
HPGD P15428 2/20 0.54
ALOX15 P16050 2/20 0.54
KMT2A Q03164 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP2C19 P33261 1/20 0.54
CYP3A4 P08684 2/20 0.50
USP2 O75604 2/20 0.50
RGS12 O14924 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL44904 1.00 HDAC8 (0.58) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL29350881 1.00 HDAC8 (0.58) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL1613174 1.00 HDAC8 (0.58) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL5965416 0.89 HDAC8 (0.52) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL21690291 0.86 CYP2C9 (0.51) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL29398382 0.86 CYP2C9 (0.51) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL29398451 0.86 CYP2C9 (0.51) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL12958085 0.86 HDAC8 (0.58) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL29868418 0.86 HDAC8 (0.58) HDAC8HDAC3HDAC1HDAC2HDAC6
SCHEMBL15745971 0.85 HDAC8 (0.57) HDAC8HDAC3HDAC1HDAC2HDAC6

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 1411 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023042201-A1 ANTIMICROBIAL PEPTIDES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2023-03-23 WO claimed
EP-3387004-B1 CYCLIC PEPTIDES TARGETING ALPHA4 BETA7 INTEGRIN ZEALAND PHARMA AS (DK) 2021-10-06 EP claimed
EP-3464324-B1 ANGIOTENSIN-1-RECEPTOR ANTAGONISTS FERRING BV (NL) 2021-04-07 EP claimed
CN-105143245-B Anti-scaling material 耶路撒冷希伯来大学伊森姆研究发展有限公司 2021-02-05 CN claimed
US-20200102348-A1 ANGIOTENSIN-1-RECEPTOR ANTAGONISTS FERRING B.V. (NL) 2020-04-02 US claimed
EP-2951195-B1 ANTIFOULING MATERIALS YISSUM RES DEV CO OF HEBREW UNIV JERUSALEM LTD (IL) 2020-02-19 EP claimed
WO-2019179985-A1 INHIBITORS OF MINT AND USES THEREOF UNIVERSITY OF COPENHAGEN (DK) 2019-09-26 WO claimed
US-10344054-B2 Angiotensin-1-receptor antagonists FERRING B.V. (NL) 2019-07-09 US claimed
EP-3464324-A1 ANGIOTENSIN-1-RECEPTOR ANTAGONISTS Ferring B.V. (NL) 2019-04-10 EP claimed
US-20170349629-A1 Angiotensin-1-Receptor Antagonists FERRING B.V. (NL) 2017-12-07 US claimed
EP-0980253-B1 SOMATOSTATIN AND SOMATOSTATIN AGONISTS FOR TREATING INSULIN INSENSITIVITY AND SYNDROME X CONSEILS DE RECH SET D APPLIC (FR) 2004-03-31 EP claimed
EP-1355940-A2 UROTENSIN-II AGONISTS AND ANTAGONISTS The Administrators of The Tulane Educational Fund (US) 2003-10-29 EP claimed
EP-0981363-B1 SOMATOSTATIN AGONISTS FOR DECREASING BODY WEIGHT SOD CONSEILS RECH APPLIC (FR) 2003-07-30 EP claimed
EP-0829011-B1 INHIBITION OF AMYLIN RELEASE UNIV BUCKINGHAM (GB) 2002-08-28 EP claimed
WO-2002032932-A2 UROTENSIN-II AGONISTS AND ANTAGONISTS THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2002-04-25 WO claimed
EP-0859785-B1 CYCLIC PEPTIDE ANALOGS OF SOMATOSTATIN BIOMEASURE INC (US) 2001-05-30 EP claimed
EP-0644893-B1 INHIBITION OF TRAUMA-INDUCED TUMOR GROWTH BIOMEASURE INC (US) 2000-04-19 EP claimed
US-5968903-A HELICOBACTER AND ANTIGROWTH AGENTS, USING SOMATOSTATIN OR AGONIST BIOMEASURE, INCORPORATED (US) 1999-10-19 US claimed
EP-0542934-B1 USE OF SOMATOSTATIN ANALOGUES FOR TREATING MELANOMAS BIOMEASURE INC (US) 1999-06-16 EP claimed
EP-0395417-B1 Linear somatostatin analogues UNIV TULANE (US) 1995-02-08 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20170349629-A1 Angiotensin-1-Receptor Antagonists AGTR1, AGTR2, REN HDAC8 574/4885HDAC3 2542/4885HDAC1 1351/4885
US-20200102348-A1 ANGIOTENSIN-1-RECEPTOR ANTAGONISTS AGTR1, AGTR2, REN HDAC8 574/4885HDAC3 2542/4885HDAC1 1351/4885
US-10344054-B2 Angiotensin-1-receptor antagonists AGTR1, AGTR2, AGT HDAC8 926/4885HDAC3 3311/4885HDAC1 1689/4885

“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.