SCHEMBL30009739

SCHEMBL30009739

c1ccc(N2CCNCC2)c(-c2ccoc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.66
HTR1A P08908 3/20 0.66
HTR6 P50406 3/20 0.66
HTR2A P28223 2/20 0.66
HTR5A P47898 2/20 0.66
CYP1A2 P05177 2/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
ADRB1 P08588 3/20 0.49
HTR3E A5X5Y0 2/20 0.45
HTR3B O95264 2/20 0.45
HTR3A P46098 2/20 0.45
HTR3D Q70Z44 2/20 0.45
HTR3C Q8WXA8 2/20 0.45
SIGMAR1 Q99720 2/20 0.45
CYP2D6 P10635 1/20 0.45
NCF1 P14598 1/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45

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
SCHEMBL404317 1.00 HTR7 (0.66) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL2548096 0.87 HTR7 (0.51) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL30022433 0.80 HTR7 (1.00) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL3759275 0.80 HTR7 (1.00) HTR7HTR1AHTR6HTR2AHTR5A
Hydrochloric Acid SCHEMBL1673713 0.78 HTR7 (0.96) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL4911490 0.75 CYP1A2 (0.52) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL941809 0.74 HTR7 (1.00) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL6630428 0.74 HDAC2 (0.42) HTR7CYP1A2LMNACYP3A4MAPT
SCHEMBL7830202 0.73 HTR7 (0.58) HTR7HTR1AHTR6HTR2AHTR5A
SCHEMBL15834279 0.73 ADRB1 (0.75) HTR7HTR1AHTR6HTR2AHTR5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570317-A2 COMPOUNDS FOR THE TREATMENT OF BOVINE OR SWINE RESPIRATORY DISEASE Intervet International B.V. (NL) 2025-06-18 EP disclosed
CN-110072844-B Compounds for the treatment of infection by Mannheimia haemolytica or histophilus somni 英特维特国际股份有限公司 2023-06-02 CN disclosed
CN-110300578-B Compounds for the treatment of respiratory diseases in cattle or pigs 英特维特国际股份有限公司 2022-12-13 CN disclosed