SCHEMBL9505550

SCHEMBL9505550

CC1(C)CC(Nc2ccc(Cl)c(N)c2)CC(C)(C)N1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
PKM P14618 2/20 0.52
MAPT P10636 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
RAD52 P43351 1/20 0.52
GFER P55789 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
TSHR P16473 1/20 0.38
IKBKB O14920 1/20 0.37
POLB P06746 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL1471429 0.86 KMT2A (0.56) KMT2AMEN1ALDH1A1LMNAPKM
Hydrochloric Acid SCHEMBL1472992 0.85 KMT2A (0.55) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL1470636 0.80 LMNA (0.51) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL1470632 0.79 MEN1 (0.52) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL1471297 0.79 KMT2A (0.49) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL10780921 0.79 ALDH1A1 (0.77) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL20357747 0.78 ALDH1A1 (0.66) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL8264452 0.77 TP53 (0.43) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL7793247 0.76 KMT2A (0.59) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL1470878 0.74 MEN1 (0.53) KMT2AMEN1ALDH1A1LMNAPKM

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
EP-0241419-B1 PIGMENTS CONTAINING PIPERIDYL GROUPS SANDOZ AG (CH) 1993-05-19 EP disclosed
EP-0241419-A2 Pigments containing piperidyl groups SANDOZ AG (CH) 1987-10-14 EP disclosed