SCHEMBL5214633

SCHEMBL5214633

CNC(=O)NC1CCNCC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 11/20 0.75
POLB P06746 1/20 0.55
EPHX2 P34913 3/20 0.51
GNAI3 P08754 1/20 0.46
GNAO1 P09471 1/20 0.46
GNAI1 P63096 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
SMYD3 Q9H7B4 4/20 0.41
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
TSHR P16473 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38

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
Hydrochloric Acid SCHEMBL21708428 0.98 EPHX1 (0.72) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL26553729 0.88 EPHX1 (0.57) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL14097638 0.88 EPHX1 (0.57) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL14097633 0.88 EPHX1 (0.57) EPHX1POLBEPHX2GNAI3GNAO1
Trifluoroacetic Acid SCHEMBL28169254 0.88 EPHX1 (0.58) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL5142091 0.86 EPHX1 (1.00) EPHX1POLBEPHX2GNAI3GNAO1
Hydrochloric Acid SCHEMBL5743237 0.86 EPHX1 (0.55) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL28171895 0.84 EPHX1 (0.95) EPHX1POLBEPHX2GNAI3GNAO1
SCHEMBL10155582 0.84 EPHX2 (0.56) EPHX1EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL965099 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4714499-A2 POLYAMIDE COMPOUNDS, METHOD FOR PREPARING SAME, AND MEDICAL USE THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2026-03-25 EP disclosed
US-20250230129-A1 POLYAMIDE COMPOUNDS, METHOD FOR PREPARING SAME, AND MEDICAL USE THEREOF JIANGSU NHWA PHARMACEUTICAL CO., LTD (CN) 2025-07-17 US disclosed
EP-4497754-A1 POLYAMIDE COMPOUNDS, METHOD FOR PREPARING SAME, AND MEDICAL USE THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2025-01-29 EP disclosed
CN-118891270-A Polyamide compound, preparation method and medical application thereof 江苏恩华药业股份有限公司 2024-11-01 CN disclosed
EP-3873600-B9 PYRIDINYL SULFONAMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2024-02-14 EP disclosed
US-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-10-19 US disclosed
WO-2023179659-A1 POLYAMIDE COMPOUNDS, METHOD FOR PREPARING SAME, AND MEDICAL USE THEREOF 江苏恩华药业股份有限公司 2023-09-28 WO disclosed
EP-3873600-B1 PYRIDINYL SULFONAMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2023-09-20 EP disclosed
US-20230174487-A1 PHENYLPROPIONAMIDE COMPOUND AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-06-08 US disclosed
US-20230174487-A1 PHENYLPROPIONAMIDE COMPOUND AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-06-08 US disclosed
US-20160311807-A1 METHODS TO TREAT LYMPHOPLASMACYTIC LYMPHOMA DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-10-27 US disclosed
CN-102464631-B Piperazine substituted 1,3-2-substituted carbamide compounds and the substituted amides compound of piperazine and its production and use 中国科学院上海药物研究所 2016-08-10 CN disclosed
WO-2015089479-A1 METHODS TO TREAT LYMPHOPLASMACYTIC LYMPHOMA DANA-FARBER CANCER INSTITUTE, INC. (US) 2015-06-18 WO disclosed
CN-102464631-A Piperazine substituted 1,3-disubstitued urea compounds and piperazine substituted amide compounds, preparation method, and use thereof SHANGHAI INST MATERIA MEDICA 2012-05-23 CN disclosed
WO-2008023159-A1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2008-02-28 WO disclosed
EP-1337512-B1 (4-ACYLAMINOPIPERIDIN-1-YL) ACETAMIDES AS NEUROKININ ANTAGONISTS BOEHRINGER INGELHEIM PHARMA (DE) 2007-06-13 EP disclosed
US-6664253-B2 N-phenethyl-2-aryl-2-(4-(oxy-or amino-carbonylamino)piperidin-1-yl)acetamide derivatives BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-12-16 US disclosed
EP-1337512-A1 (4-ACYLAMINOPIPERIDIN-1-YL) ACETAMIDES AS NEUROKININ ANTAGONISTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-08-27 EP disclosed
US-20020115666-A1 Neurokinin antagonists BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-22 US disclosed
WO-2002032866-A1 (4-ACYLAMINOPIPERIDIN-1-YL) ACETAMIDES AS NEUROKININ ANTAGONISTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-04-25 WO 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 (5 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-20250230129-A1 POLYAMIDE COMPOUNDS, METHOD FOR PREPARING SAME, AND MEDICAL USE THEREOF ADCYAP1R1, PAICS, AGPS EPHX1 2964/4885POLB 299/4885EPHX2 443/4885
US-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 EPHX1 3679/4885POLB 2637/4885EPHX2 1688/4885
US-20020115666-A1 Neurokinin antagonists TACR2, TACR1, NPSR1 EPHX1 2806/4885POLB 4863/4885EPHX2 3126/4885
US-20160311807-A1 METHODS TO TREAT LYMPHOPLASMACYTIC LYMPHOMA IRAK1, IRAK4, IRAK2 EPHX1 1227/4885POLB 2303/4885EPHX2 2632/4885
US-20230174487-A1 PHENYLPROPIONAMIDE COMPOUND AND USE THEREOF PAH, TRPV1, TRPA1 EPHX1 267/4885POLB 3687/4885EPHX2 448/4885

“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.