SCHEMBL11249347

SCHEMBL11249347

Fc1ccc(Sc2ccccc2CCl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
SLC6A4 P31645 5/20 0.46
HTR1A P08908 1/20 0.45
HTR3A P46098 1/20 0.45
SLC6A2 P23975 4/20 0.44
SLC6A3 Q01959 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
CHRNA7 P36544 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.39
DHFR P00374 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RHEB Q15382 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
SCHEMBL11705626 0.83 SLC6A4 (0.65) LMNASLC6A4HTR1AHTR3ASLC6A2
SCHEMBL11287076 0.81 APOBEC3G (0.53) LMNASLC6A4HTR1AHTR3ASLC6A2
SCHEMBL12462599 0.81 SLC6A4 (0.47) LMNASLC6A4HTR1AHTR3ASLC6A2
Hydrochloric Acid SCHEMBL8530226 0.80 CYP2C9 (0.59) LMNASLC6A4SLC6A2SLC6A3SMN1; SMN2
SCHEMBL30548760 0.80 HTR1A (0.51) LMNASLC6A4HTR1AHTR3ASLC6A2
SCHEMBL5250559 0.80 SLC6A4 (0.42) LMNASLC6A4SLC6A2SLC6A3CHRNA7
SCHEMBL11704531 0.79 AGBL2 (0.46) SLC6A4SLC6A2SLC6A3HPGDCHRNA7
SCHEMBL11481374 0.78 SLC6A4 (0.43) SLC6A4HTR1AHTR3ASLC6A2SLC6A3
SCHEMBL11761184 0.77 ATM (0.46) SLC6A4CYP2C9HPGDCYP2C19MEN1
SCHEMBL11759797 0.77 MEN1 (0.44) SLC6A4HTR1AHTR3ACYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013424-B1 SPIRO(DIBENZO(B,F)THIEPINE-PIPERIDINES), INTERMEDIATE PRODUCTS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1982-11-17 EP disclosed
EP-0013424-A1 Spiro(dibenzo(b,f)thiepine-piperidines), intermediate products for their preparation and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1980-07-23 EP disclosed
US-4198420-A Spiro[dibenz(b,f)thiepin-piperidine]s AMERICAN HOECHST CORPORATION (US) 1980-04-15 US disclosed
US-4198419-A Phenylthiophenylpiperidines AMERICAN HOECHST CORPORATION (US) 1980-04-15 US disclosed