SCHEMBL304452

SCHEMBL304452

CN(CC(=O)O)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
CA12 O43570 1/20 0.55
CA9 Q16790 1/20 0.55
LTA4H P09960 1/20 0.54
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
TSHR P16473 2/20 0.52
CARM1 Q86X55 1/20 0.52
PRMT6 Q96LA8 1/20 0.52
PRMT8 Q9NR22 1/20 0.52
ACHE P22303 2/20 0.51
BCHE P06276 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 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
Potassium SCHEMBL6997235 0.98 RAB9A (0.53) RAB9ANPC1CA12CA9LTA4H
Hydrochloric Acid SCHEMBL5760483 0.98 RAB9A (0.53) RAB9ANPC1CA12CA9LTA4H
SCHEMBL17083316 0.89 TAAR1 (0.58) LTA4HALDH1A1KDM4ETSHRUSP2
SCHEMBL4741844 0.87 KMT2A (0.65) RAB9ALTA4HACHEKMT2AMEN1
SCHEMBL3106474 0.86 RAB9A (0.53) RAB9ANPC1CA12CA9ALDH1A1
SCHEMBL6444116 0.86 RAB9A (0.53) RAB9ANPC1CA12CA9ALDH1A1
SCHEMBL20340713 0.85 RAB9A (0.53) RAB9ANPC1CA12CA9ALDH1A1
SCHEMBL4182138 0.84 CARM1 (0.53) RAB9ANPC1CA12CA9ALDH1A1
SCHEMBL17083311 0.84 PYCR1 (0.50) RAB9ALTA4HALDH1A1KMT2AMEN1
SCHEMBL4182133 0.84 RAB9A (0.52) RAB9ANPC1CA12CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3945811-A CROSSLINKED MACRORETICULAR RESIN ROHM AND HAAS COMPANY (US) 1976-03-23 US claimed
CN-120208797-A Preparation method of epinephrine 上海现代哈森(商丘)药业有限公司 2025-06-27 CN disclosed
CN-115584631-B Treating agent for synthetic fibers and synthetic fibers 竹本油脂株式会社 2024-05-03 CN disclosed
CN-115584631-A Treating agent for synthetic fiber and synthetic fiber 竹本油脂株式会社 2023-01-10 CN disclosed
US-10196345-B2 MAO-B selective inhibitor compounds, pharmaceutical compositions thereof and uses thereof THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2019-02-05 US disclosed
EP-2499127-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-09-05 EP disclosed
US-20170355689-A1 HEPATITIS C VIRUS INHIBITOR BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
US-20170355689-A1 HEPATITIS C VIRUS INHIBITOR BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
US-20170355689-A1 HEPATITIS C VIRUS INHIBITOR BRISTOL MYERS SQUIBB CO (US) 2017-12-14 US disclosed
US-20170320833-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-11-09 US disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
US-5386009-A Lipopeptide derivatives MERCK & CO. INC. (US) 1995-01-31 US disclosed
US-5385884-A Water-soluble, injectible echinocandins; fungicides; antiprotozoa agents, yeasts MERCK & CO. INC. (US) 1995-01-31 US disclosed
US-5378690-A Treatment of angiotensin induced hypertension SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
US-5330973-A Fungicides, antiprotozoa agents MERCK & CO., INC. (US) 1994-07-19 US disclosed
EP-0503960-A1 Cyclic lipopeptides having antibiotic activity MERCK & CO. INC. (US) 1992-09-16 EP disclosed
EP-0448354-A2 Lipopeptide derivatives MERCK & CO. INC. (US) 1991-09-25 EP disclosed
EP-0448343-A2 Lipopeptide derivatives MERCK & CO. INC. (US) 1991-09-25 EP disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 EP disclosed
US-3945811-A CROSSLINKED MACRORETICULAR RESIN ROHM AND HAAS COMPANY (US) 1976-03-23 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 (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-20170355689-A1 HEPATITIS C VIRUS INHIBITOR HAVCR2, LIPC, PYGL RAB9A 2545/4885NPC1 72/4885CA12 3444/4885
US-10196345-B2 MAO-B selective inhibitor compounds, pharmaceutical compositions thereof and uses thereof MAOB, MAOA, COMT RAB9A 2129/4885NPC1 1244/4885CA12 2206/4885
US-20170320833-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, PYGL, HCCS RAB9A 2463/4885NPC1 65/4885CA12 3169/4885

“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.