SCHEMBL20709296

SCHEMBL20709296

C=C(Cc1ccc(CC)cc1)Nc1ccc(C(C)CC(C)(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ATM Q13315 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 1/20 0.37
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 6/20 0.36
NPC1 O15118 5/20 0.36
HPGD P15428 1/20 0.36
SRC P12931 1/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35

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
SCHEMBL20709269 0.73 SMN1; SMN2 (0.39) KMT2ASMN1; SMN2LMNARAB9ANPC1
SCHEMBL20709259 0.73 SMN1; SMN2 (0.40) KMT2ASMN1; SMN2LMNACRHBPCRHR2
SCHEMBL20179130 0.69 HDAC1 (0.55) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL5918492 0.69 RIPK1 (0.46)
SCHEMBL20179330 0.67 ALDH1A1 (0.52) KMT2ASMN1; SMN2RAB9ANPC1HPGD
SCHEMBL20709267 0.67 KEAP1 (0.46) KMT2ASMN1; SMN2LMNARAB9ANPC1
SCHEMBL24533708 0.65 GRIA4 (0.38) LMNACYP2D6GRIN2B
SCHEMBL507696 0.65 HRH3 (0.39)
SCHEMBL28429831 0.64 RIPK1 (0.39) KMT2ASMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL21386360 0.64 SRC (0.52) KMT2AATMSMN1; SMN2LMNARAB9A

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
EP-3077372-B1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING BV (NL) 2019-02-06 EP disclosed