SCHEMBL8399574

SCHEMBL8399574

CC1(C)CC(OOCc2ccccc2)CC(C)(C)N1[O]

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TP53 P04637 2/20 0.39
TSHR P16473 3/20 0.38
KMT2A Q03164 1/20 0.38
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSK P43235 1/20 0.35
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
HTR2C P28335 1/20 0.34
DHFR P00374 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL1150161 0.84 CTSL (0.46) ALDH1A1TP53TSHRKMT2ACTSL
SCHEMBL12532630 0.81 TSHR (0.60) ALDH1A1TSHRKMT2AGAAHTT
SCHEMBL12532645 0.80 KMT2A (0.65) ALDH1A1TSHRKMT2AGAAHTT
SCHEMBL12532643 0.79 TSHR (0.38) ALDH1A1TP53TSHRKMT2ACTSL
SCHEMBL9870972 0.78 GAA (0.48) ALDH1A1TSHRKMT2AOPRM1OPRL1
SCHEMBL12532631 0.78 TSHR (0.47) ALDH1A1TSHRKMT2ANPC1GAA
SCHEMBL12532641 0.74 KMT2A (0.47) ALDH1A1TSHRKMT2AGAAHTT
SCHEMBL8879727 0.73 TSHR (0.46) TSHRCTSLCTSBCTSKOPRM1
SCHEMBL578355 0.72 CCR3 (0.42) ALDH1A1KMT2AGAA
SCHEMBL6754518 0.72 SLC6A2 (0.45) TSHRKMT2ACTSLCTSBCTSK

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-0921170-A1 Utilisation of linear non-dienic type block copolymers as auto-adhesives or auto-adhesive components ELF ATOCHEM S.A. (FR) 1999-06-09 EP disclosed