SCHEMBL22749030

SCHEMBL22749030

CCCCCCCCCCC/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)O.CCCCCCCCCCCCC/C=C/C=C/C=C/C=C/C=C/C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.65
FASN P49327 1/20 0.65
KDM4E B2RXH2 1/20 0.63
ALDH1A1 P00352 1/20 0.57
TSHR P16473 1/20 0.57
CNR1 P21554 2/20 0.55
CNR2 P34972 2/20 0.55
FAAH O00519 2/20 0.54
GMNN O75496 1/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
CYP2C9 P11712 1/20 0.53
ALOX15 P16050 1/20 0.53
APEX1 P27695 1/20 0.53
CYP2C19 P33261 1/20 0.53
RECQL P46063 1/20 0.53
BLM P54132 1/20 0.53

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
SCHEMBL10977120 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL15440591 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL3227940 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL8403803 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL10980307 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL18185437 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL296231 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL7121862 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL20499878 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR
SCHEMBL14858316 1.00 PTPN1 (0.65) PTPN1FASNKDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020245320-A1 OPTIMAL CHROMOSOMAL INSERTION LOCI INBIOSE N.V. (BE) 2020-12-10 WO disclosed