SCHEMBL1582995

SCHEMBL1582995

O=C1CCCc2onc(-c3ccccc3)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.46
PTGS2 P35354 7/20 0.45
PTGS1 P23219 3/20 0.45
BRD4 O60885 1/20 0.43
KMT2A Q03164 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MT-CO2 P00403 3/20 0.39
LMNA P02545 2/20 0.38
MAPK10 P53779 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL9024407 0.84 HTR2A (0.49) HTR7PTGS2ALDH1A1SMN1; SMN2KDM4E
SCHEMBL9445146 0.84 HTR2A (0.50) HTR7PTGS2PTGS1BRD4KMT2A
SCHEMBL9024716 0.83 HTR7 (0.53) HTR7L3MBTL1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL9024154 0.79 HTR7 (0.51) HTR7PTGS1BRD4KMT2AL3MBTL1
SCHEMBL14014136 0.79 BRD4 (0.48) BRD4KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL8789344 0.79 NPC1 (0.44) KMT2AALDH1A1SMN1; SMN2MEN1LMNA
SCHEMBL9445149 0.75 PTGS2 (0.46) HTR7PTGS2PTGS1KMT2AALDH1A1
SCHEMBL8781944 0.75 KMT2A (0.40) KMT2AL3MBTL1ALDH1A1MEN1MAPT
SCHEMBL9024849 0.68 SMN1; SMN2 (0.42) BRD4KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL28636166 0.68 BRD4 (0.47) BRD4KMT2AALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4230673-A None JP disclosed
EP-2895175-B1 METHODS OF PRODUCING MOLINDONE AND ITS SALTS SUPERNUS PHARMACEUTICALS INC (US) 2017-07-12 EP disclosed
EP-1546100-B1 NEW BENZOYL PIPERIDINE COMPOUNDS SK HOLDINGS CO LTD (KR) 2011-04-20 EP disclosed
US-6770659-B2 Benzoyl piperidine compounds SK CORPORATION (KR) 2004-08-03 US disclosed
US-20040044033-A1 New benzoyl piperidine compounds SK BIOPHARMACEUTICALS CO., LTD. (KR) 2004-03-04 US disclosed
EP-0474012-B1 6,7-Dihydro-3-phenyl-1,2-benzisoxazol-4(5H)-ones and -ols, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-11-27 EP disclosed
EP-0474012-B1 6,7-Dihydro-3-phenyl-1,2-benzisoxazol-4(5H)-ones and -ols, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-11-27 EP disclosed
EP-0401779-B1 4,5,5a,6-Tetrahydro-3H-isoxazolo (5,4,3-kl)acridines derivatives, a process for their preparation and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1995-05-03 EP disclosed
US-5256672-A Antipsychotic, analgesic HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-10-26 US disclosed
US-5256672-A Antipsychotic, analgesic HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-10-26 US disclosed
US-5180834-A Antipsychotic agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-01-19 US disclosed
JP-H04230673-A 6,7-DIHYDRO-3-PHENYL-1,2-BENZISOXAZOLE-4(5H)-ONE AND-OL, ITS PRODUCTION AND ITS USE AS MEDICINE HOECHST ROUSSEL PHARMACEUT INC 1992-08-19 JP disclosed
US-5114936-A Antipsychotic and analgesic agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-05-19 US disclosed
US-5114936-A Antipsychotic and analgesic agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-05-19 US disclosed
EP-0474012-A1 6,7-Dihydro-3-phenyl-1,2-benzisoxazol-4(5H)-ones and -ols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-03-11 EP disclosed
EP-0474012-A1 6,7-Dihydro-3-phenyl-1,2-benzisoxazol-4(5H)-ones and -ols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-03-11 EP disclosed
EP-0474012-A1 6,7-Dihydro-3-phenyl-1,2-benzisoxazol-4(5H)-ones and -ols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-03-11 EP disclosed
EP-0401779-A1 4,5,5a,6-Tetrahydro-3H-isoxazolo (5,4,3-kl)acridines derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-12-12 EP disclosed
US-4942237-A REACTING A KETOBENZISOXAZOLE WITH HYDRAZOIC ACID AND SULFURIC ACID HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-07-17 US disclosed
US-4920117-A ANALGESICS, TREATMENT OF MEMORY DYSFUNCTIONS; ALZHEIMER'S DISEASE HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-04-24 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 (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-20040044033-A1 New benzoyl piperidine compounds GABRE, GRIN2C, GRIN1 HTR7 780/4885PTGS2 3382/4885PTGS1 2611/4885

“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.