SCHEMBL1473424

SCHEMBL1473424

CC(=O)N1CCC(c2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.61
KCNH2 Q12809 1/20 0.60
HRH3 Q9Y5N1 1/20 0.60
NPY5R Q15761 1/20 0.60
SLC18A3 Q16572 2/20 0.55
POLB P06746 3/20 0.54
ALDH1A1 P00352 3/20 0.54
NPC1 O15118 1/20 0.54
TP53 P04637 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
BACE1 P56817 1/20 0.54
KDM4E B2RXH2 1/20 0.54
BRD4 O60885 1/20 0.54
CREBBP Q92793 1/20 0.54
HSD11B1 P28845 3/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52

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
SCHEMBL7477011 0.91 SLC18A3 (0.59) QDPRKCNH2HRH3NPY5RSLC18A3
SCHEMBL19493962 0.89 RAB9A (0.63) KCNH2HRH3POLBALDH1A1NPC1
SCHEMBL1197270 0.89 RAB9A (0.63) KCNH2HRH3POLBALDH1A1NPC1
SCHEMBL13589641 0.86 HRH3 (0.57) KCNH2HRH3SLC18A3POLBALDH1A1
SCHEMBL27888979 0.85 KCNH2 (0.73) KCNH2HRH3SLC18A3POLBALDH1A1
SCHEMBL1531725 0.85 KCNH2 (0.59) KCNH2HRH3SLC18A3POLBALDH1A1
SCHEMBL7230489 0.84 QDPR (0.60) QDPRKCNH2HRH3NPY5RPOLB
SCHEMBL12874043 0.84 QDPR (0.64) QDPRNPY5RSLC18A3ALDH1A1NPC1
SCHEMBL7277302 0.84 QDPR (0.69) QDPRKCNH2HRH3NPY5RPOLB
Hydrogen Sulfide SCHEMBL27863722 0.83 KCNH2 (0.58) KCNH2HRH3SLC18A3POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 US disclosed
EP-3184520-B1 SALT OF MONOCYCLIC PYRIDINE DERIVATIVE AND CRYSTAL THEREOF EISAI R&D MAN CO LTD (JP) 2022-03-23 EP disclosed
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-05-11 US disclosed
EP-3209664-B1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-06-03 EP disclosed
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-10-29 US disclosed
US-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-02-14 US disclosed
US-9951047-B2 Salt of monocyclic pyridine derivative and crystal thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-04-24 US disclosed
US-9951047-B2 Salt of monocyclic pyridine derivative and crystal thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-04-24 US disclosed
US-9951047-B2 Salt of monocyclic pyridine derivative and crystal thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-04-24 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
EP-0608858-A1 5-Membered heterocycles as aggregation inhibitors Dr. Karl Thomae GmbH (DE) 1994-08-03 EP disclosed
EP-0604800-A1 4- 4- 4-(carboxyalkyl)-phenyl amino carbonyl -phenyl -piperedines as aggregation inhibitors Dr. Karl Thomae GmbH (DE) 1994-07-06 EP disclosed
EP-0294220-B1 Photopolymerizable composition HITACHI CHEMICAL CO LTD (JP) 1994-05-25 EP disclosed
EP-0592949-A2 N-(aminocarbonyl)-piperidines/pepirazines as aggregation inhibiting agents Dr. Karl Thomae GmbH (DE) 1994-04-20 EP disclosed
CN-1083485-A Benzo thia azepine and benzo oxa-azepine derivatives PFIZER (US) 1994-03-09 CN disclosed
EP-0291210-B1 ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1991-11-06 EP disclosed
US-5034429-A An unsaturated monomer, a photoinitiator and a benzene derivative for providing a cured film HITACHI CHEMICAL CO., LTD. (JP) 1991-07-23 US disclosed
US-4835165-A Antiarrhythmic 4-phenylpiperidines PFIZER INC. (US) 1989-05-30 US disclosed
EP-0294220-A2 Photopolymerizable composition Hitachi Chemical Co., Ltd. (JP) 1988-12-07 EP disclosed
US-4188396-A ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1980-02-12 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 (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-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 QDPR 3252/4885KCNH2 1719/4885HRH3 719/4885
US-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 QDPR 3252/4885KCNH2 1719/4885HRH3 719/4885
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 QDPR 3158/4885KCNH2 1705/4885HRH3 729/4885
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 QDPR 3252/4885KCNH2 1719/4885HRH3 719/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 QDPR 331/4885KCNH2 3447/4885HRH3 131/4885

“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.