SCHEMBL197990

SCHEMBL197990

O=C(O)[C@@H]1CC(c2ccccc2)CN1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 7/20 0.65
DPP4 P27487 3/20 0.52
AKR1C3 P42330 1/20 0.49
AKR1C1 Q04828 1/20 0.49
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47
SLC1A3 P43003 1/20 0.47
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
RPS6KB1 P23443 1/20 0.44
F2 P00734 1/20 0.42

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
SCHEMBL5201978 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL124005 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL7870187 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL20011747 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL199332 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL25396765 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL8512122 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
SCHEMBL197989 1.00 HDAC2 (0.65) HDAC2DPP4AKR1C3AKR1C1CYP1A2
Hydrochloric Acid SCHEMBL18094024 0.98 HDAC2 (0.63) HDAC2DPP4AKR1C3AKR1C1CYP1A2
Hydrochloric Acid SCHEMBL10461198 0.98 HDAC2 (0.63) HDAC2DPP4AKR1C3AKR1C1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271224-A Preparation method of (2S, 4S) -4-cyclohexyl-L-proline 浙江华海药业股份有限公司 2024-07-02 CN claimed
CN-114516825-A Method for preparing (2S,4S) -4-cyclohexyl-L-proline 浙江华海药业股份有限公司 2022-05-20 CN claimed
CN-111303002-B Method for treating fosinopril intermediate mother liquor 浙江工业大学 2021-05-07 CN claimed
CN-111303002-A Method for treating fosinopril intermediate mother liquor 浙江工业大学 2020-06-19 CN claimed
WO-2019011879-A1 THERAPEUTIC FOR TREATING CAPILLARY LEAK SYNDROME HENNING RAINER (CH) 2019-01-17 WO claimed
EP-2922559-B1 SYNTHETIC LINEAR APELIN MIMETICS FOR THE TREATMENT OF HEART FAILURE NOVARTIS AG (CH) 2018-10-10 EP claimed
US-10005829-B2 Synthetic linear apelin mimetics for the treatment of heart failure NOVARTIS AG (CH) 2018-06-26 US claimed
CN-105007928-B For treating the synthesizing linear APELIN analogies of heart failure 诺华股份有限公司 2018-03-20 CN claimed
EP-3154568-A1 NON-CANONICAL INSULINS AND THEIR USES California Institute of Technology (US) 2017-04-19 EP claimed
US-20160076058-A1 HYDROCARBON-PRODUCING GENES AND METHODS OF THEIR USE GENOMATICA, INC. 2016-03-17 US claimed
EP-1062222-A1 SERINE PEPTIDASE MODULATORS Fondatech Benelux N.V. (BE) 2000-12-27 EP claimed
US-6090786-A HALOPYRROLE AMIDATED AMINO ACID USEFUL FOR INHIBITING SERINE PROTEASE ACTIVITY FONDATECH BENELUX N.V. (BE) 2000-07-18 US claimed
WO-1999046272-A1 SERINE PEPTIDASE MODULATORS FONDATECH BENELUX N.V. (BE) 1999-09-16 WO claimed
EP-0764151-A2 PURIFICATION OF SERINE PROTEASE AND SYNTHETIC INHIBITORS THEREOF UNIVERSITAIRE INSTELLING ANTWERPEN (BE) 1997-03-26 EP claimed
EP-0732399-A2 Chymotrypsin-like proteases and their inhibitors CEPHALON, INC. (US) 1996-09-18 EP claimed
WO-1995034538-A2 PURIFICATION OF SERINE PROTEASES AND SYNTHETIC INHIBITORS THEREOF UNIVERSITAIRE INSTELLING ANTWERPEN (BE) 1995-12-21 WO claimed
EP-0518955-A4 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS 1993-09-22 EP claimed
EP-0518955-A1 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS CEPHALON, INC. (US) 1992-12-23 EP claimed
WO-1991013904-A1 CHYMOTRYPSIN-LIKE PROTEASES AND THEIR INHIBITORS CEPHALON, INC. (US) 1991-09-19 WO claimed
US-4912231-A Reacting a proline derivative with an aromatic nucleophile in presence of a Lewis acid catalyst E. R. SQUIBB & SONS, INC. (US) 1990-03-27 US 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 (1 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-10005829-B2 Synthetic linear apelin mimetics for the treatment of heart failure APLNR, AP3B1, FABP3 HDAC2 4410/4885DPP4 165/4885AKR1C3 1893/4885

“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.