SCHEMBL24316262

SCHEMBL24316262

CCCC1(OC)CN(Cc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 3/20 0.47
USP2 O75604 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 3/20 0.46
MAPK1 P28482 3/20 0.46
GAA P10253 2/20 0.46
PKM P14618 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL26620516 0.91 TSHR (0.56) TSHRALDH1A1KDM4EUSP2HSD17B10
SCHEMBL27010446 0.86 ALDH1A1 (0.58) TSHRALDH1A1KDM4EUSP2HSD17B10
SCHEMBL24316062 0.84 TSHR (0.58) TSHRALDH1A1KDM4EUSP2HSD17B10
SCHEMBL27010323 0.81 ALDH1A1 (0.57) TSHRALDH1A1KDM4EUSP2HSD17B10
SCHEMBL26620219 0.81 TSHR (0.64) TSHRALDH1A1KDM4EUSP2LMNA
SCHEMBL24317323 0.81 NPC1 (0.43) TSHRALDH1A1USP2SMN1; SMN2GAA
SCHEMBL24317304 0.80 TSHR (0.60) TSHRALDH1A1KDM4EUSP2LMNA
SCHEMBL26620513 0.80 TSHR (0.60) TSHRALDH1A1KDM4EUSP2LMNA
SCHEMBL26635523 0.80 TSHR (0.54) TSHRALDH1A1KDM4EUSP2LMNA
SCHEMBL26636731 0.79 TSHR (0.58) TSHRALDH1A1KDM4EUSP2LMNA

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
WO-2022081925-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed