SCHEMBL23934909

SCHEMBL23934909

CCC(C)(C)c1cc(C(C)(C)C)c(N)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 6/20 0.34
MAPK1 P28482 5/20 0.34
LMNA P02545 1/20 0.34
CASP3 P42574 1/20 0.34
ATM Q13315 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
NPSR1 Q6W5P4 4/20 0.33
HTT P42858 3/20 0.33
ALDH1A1 P00352 2/20 0.33
UBE2N P61088 2/20 0.33
MITF O75030 1/20 0.33
HSP90AA1 P07900 1/20 0.32

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
SCHEMBL139484 0.79 POLB (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL11793577 0.78 CA2 (0.54) MAPTPOLBSMN1; SMN2MAPK1LMNA
SCHEMBL19648629 0.77 SMN1; SMN2 (0.33) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL780091 0.75 NPC1 (0.43) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL24653295 0.75 NPC1 (0.48) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL21557594 0.75 NPC1 (0.48) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL21654203 0.74 MAPT (0.42) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL15065431 0.74 HSP90AA1 (0.46) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL18630379 0.74 CYP2C9 (0.57) MAPTPOLBSMN1; SMN2MAPK1LMNA
SCHEMBL1930161 0.73 HSPA5 (0.52) MAPTPOLBSMN1; SMN2MAPK1LMNA

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-4102590-A2 COMPOSITION, LAYER INCLUDING THE COMPOSITION, LIGHT-EMITTING DEVICE INCLUDING THE COMPOSITION, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2022-12-14 EP disclosed
EP-3705483-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2021-10-20 EP disclosed