SCHEMBL6098708

SCHEMBL6098708

COC1=CC=Cc2ccccc2N1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
GAA P10253 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 1/20 0.37
NPC1 O15118 1/20 0.33
P2RX4 Q99571 1/20 0.31
NOX1 Q9Y5S8 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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 SCHEMBL28604267 0.77 GAA (0.44) MAPTGAA
SCHEMBL28658376 0.75 MAPT (0.41) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL9164081 0.75 MAPT (0.41) MAPTGAASMN1; SMN2RAB9ALMNA
SCHEMBL1249108 0.75 MAPT (0.54) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL27552412 0.74 MAPT (0.40) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL10880606 0.74 GAA (0.40) MAPTGAAMEN1MAPK1KMT2A
SCHEMBL3193087 0.73 ALOX15 (0.42) MAPTGAASMN1; SMN2RAB9AMEN1
SCHEMBL27283728 0.71 MAPT (0.45) MAPTGAASMN1; SMN2RAB9ANPC1
SCHEMBL460837 0.71 MAPT (0.54) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL8769697 0.71 MAPT (0.54) MAPTGAASMN1; SMN2RAB9AP2RX4

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1038099-A Alpha-adrenergic aceptor antagonist SMITHKLINE BECKMAN CORP (US) 1989-12-20 CN claimed
CN-111479813-B Triazolobenzazepines as vasopressin V1A receptor antagonists 吉瑞工厂 2023-03-21 CN disclosed
CN-111479813-A Triazolobenzazepines as vasopressin V1A receptor antagonists 吉瑞工厂 2020-07-31 CN disclosed
US-7022694-B2 Indoles and indolines having 5-HT activity PHARMACIA & UPJOHN COMPANY (US) 2006-04-04 US disclosed
EP-1406902-B1 HEXAHYDROAZEPINO[4,5-G]INDOLES AND INDOLINES AS 5-HT RECEPTOR LIGANDS PHARMACIA & UPJOHN CO LLC (US) 2005-10-19 EP disclosed
EP-1406902-A1 HEXAHYDROAZEPINO(4,5-G)INDOLES AND INDOLINES AS 5-HT RECEPTOR LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-04-14 EP disclosed
US-20030060458-A1 Indoles and indolines having 5-HT activity PHARMACIA & UPJOHN COMPANY 2003-03-27 US disclosed
WO-2003006466-A1 HEXAHYDROAZEPINO (4, 5-G) INDOLES AND INDOLINES AS 5-HT RECEPTOR LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2003-01-23 WO disclosed
EP-0230755-B1 1-PHENYL-3-BENZAZEPINES SMITHKLINE BEECHAM CORPORATION (US) 1990-05-16 EP disclosed
CN-1039810-A ALPHA-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BECKMAN CORP (US) 1990-02-21 CN disclosed
CN-1038099-A Alpha-adrenergic aceptor antagonist SMITHKLINE BECKMAN CORP (US) 1989-12-20 CN disclosed
US-4707483-A 1-phenyl-3-benzazepines and their use for treating gastrointestinal motility disorders SMITHKLINE BECKMAN CORPORATION (US) 1987-11-17 US disclosed
EP-0230755-A1 1-Phenyl-3-benzazepines SMITHKLINE BEECHAM CORPORATION (US) 1987-08-05 EP 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-20030060458-A1 Indoles and indolines having 5-HT activity TPH1, HTR5A, TPH2 MAPT 2607/4885GAA 4374/4885SMN1; SMN2 3431/4885

“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.