SCHEMBL8628296

SCHEMBL8628296

Cc1ccccc1N1CCN(Cn2ncc3ccccc32)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.45
HSD17B10 Q99714 4/20 0.44
POLB P06746 3/20 0.44
RECQL P46063 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ATM Q13315 1/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 4/20 0.42
HTR1A P08908 1/20 0.42
P2RX7 Q99572 1/20 0.42
TSHR P16473 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GPR35 Q9HC97 2/20 0.42
ALOX15 P16050 1/20 0.42
ADRA1A P35348 2/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1B P35368 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL8631570 0.82 MAPT (0.47) HTR7HSD17B10POLBRECQLL3MBTL1
SCHEMBL8633681 0.81 RECQL (0.50) HSD17B10POLBRECQLL3MBTL1HTR1A
SCHEMBL8631540 0.79 KCNH2 (0.51) HTR7HSD17B10POLBRECQLL3MBTL1
SCHEMBL8628029 0.79 DRD2 (0.46) HTR7HSD17B10POLBRECQLL3MBTL1
SCHEMBL8627836 0.78 DRD4 (0.45) HSD17B10POLBRECQLL3MBTL1LMNA
SCHEMBL29520874 0.78 RECQL (0.53) HSD17B10POLBRECQLL3MBTL1P2RX7
SCHEMBL6977835 0.77 RECQL (0.51) HSD17B10POLBRECQLL3MBTL1P2RX7
SCHEMBL8628179 0.76 KDM4E (0.50) HSD17B10POLBLMNAHTR1AKDM4E
SCHEMBL8629124 0.76 DRD4 (0.48) L3MBTL1HTR1AADRA1AADRA1DADRA1B
SCHEMBL8629425 0.76 DRD4 (0.56) POLBRECQLLMNAHTTHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876332-A1 PHENYLACETIC ACID DERIVATIVES, PROCESS AND INTERMEDIATE PRODUCTS FOR USE IN PRODUCING THEM AND AGENTS CONTAINING THEM BASF AKTIENGESELLSCHAFT (DE) 1998-11-11 EP disclosed
US-5780475-A Antipsychotic indazole derivatives MERCK, SHARP & DOHME LIMITED (GB) 1998-07-14 US disclosed
EP-0850216-A1 HYDROXIMIC ACID DERIVATIVES, A PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-07-01 EP disclosed
WO-1997015552-A1 PHENYLACETIC ACID DERIVATIVES, PROCESS AND INTERMEDIATE PRODUCTS FOR USE IN PRODUCING THEM AND AGENTS CONTAINING THEM BASF AKTIENGESELLSCHAFT (DE) 1997-05-01 WO disclosed
WO-1997006133-A1 HYDROXIMIC ACID DERIVATIVES, A PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES AND FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-02-20 WO disclosed
WO-1993016033-A1 CYCLOHEXENONE OXIME ETHERS, METHODS OF PREPARING THEM AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed