SCHEMBL8197300

SCHEMBL8197300

CCC1(c2ccccc2Br)NC1(CC)c1ccccc1Br

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.41
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.32
HTR7 P34969 1/20 0.32
CYP2D6 P10635 1/20 0.31
TAAR1 Q96RJ0 2/20 0.31
RIPK1 Q13546 1/20 0.30
LMNA P02545 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
SCHEMBL8210187 0.76 ALOX15 (0.34) ALDH1A1
SCHEMBL8497537 0.75 GRIN1 (0.42) KDM1ARCOR1TSHRHTR7TAAR1
SCHEMBL3214592 0.67 KDM1A (0.36) PDE7AKDM1ARCOR1HTR2AHTR2C
SCHEMBL2202766 0.66 PDE7A (0.39) PDE7ATSHRCYP2D6
Propane SCHEMBL11811265 0.66 ALDH1A1 (0.53) ALDH1A1TSHRHTR7CYP2D6TAAR1
SCHEMBL8223799 0.65 CNR1 (0.38) KDM1ARCOR1ALDH1A1TAAR1
SCHEMBL8204686 0.64 ALDH1A1 (0.39) KDM1ARCOR1ALDH1A1CYP2D6TAAR1
SCHEMBL28531121 0.62 ALDH1A1 (0.39) PDE7AKDM1AHTR2AHTR2CALDH1A1
SCHEMBL18012716 0.62 PDK2 (0.50) PDE7AKDM1ARCOR1ALDH1A1CYP2D6
Alcohol SCHEMBL19689479 0.61 ALDH1A1 (0.48) ALDH1A1TSHRHTR7CYP2D6TAAR1

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
US-6093851-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-07-25 US disclosed
EP-0735018-B1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL CO (JP) 1999-07-21 EP disclosed
US-5739401-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-14 US disclosed
EP-0735018-A1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed