SCHEMBL8615916

SCHEMBL8615916

CC(C)N(Cc1ccc(P(c2ccc(CN(C(C)C)C(C)C)cc2)c2ccc3ccccc3c2-c2c(O)ccc3ccccc23)cc1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.41
MEN1 O00255 3/20 0.40
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
PSEN1 P49768 3/20 0.37
PSEN2 P49810 3/20 0.37
APH1B Q8WW43 3/20 0.37
NCSTN Q92542 3/20 0.37
APH1A Q96BI3 3/20 0.37
PSENEN Q9NZ42 3/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
NSD2 O96028 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
HKDC1 Q2TB90 1/20 0.36

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
SCHEMBL8611380 0.89 KMT2A (0.38) KMT2AMEN1MAPTKDM4ETDP1
SCHEMBL8612267 0.89 HSP90AA1 (0.40) KMT2AMEN1MAPTKDM4ETDP1
SCHEMBL4004222 0.78 PTPN22 (0.44) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL6928512 0.78 PTPN22 (0.44) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL8613770 0.78 RRM1 (0.45) KMT2AMEN1MAPTKDM4ETDP1
SCHEMBL7590618 0.73 MAPT (0.43) KMT2AMEN1MAPTKDM4ETDP1
SCHEMBL8610345 0.73 HDAC1 (0.38) KMT2AMEN1HDAC1HDAC8HDAC6
SCHEMBL8611033 0.72 MAPT (0.47) KMT2AMEN1MAPTKDM4ETDP1
SCHEMBL8723999 0.70 CYP3A4 (0.44) KMT2AMEN1TDP1ALDH1A1HDAC1
SCHEMBL7902294 0.70 GAA (0.39) TDP1ALDH1A1GAACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5789623-A Process for the preparation of hydroxybiarylphosphines and novel compounds of this group of substances HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
EP-0748811-A1 Process for the preparation of hydroxybiarylphosphanes and novel compounds from this materials group HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-18 EP disclosed