SCHEMBL24316210

SCHEMBL24316210

COc1ncc(CNC2CCCCC2NC(C)I)cn1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.39
MAOA P21397 6/20 0.39
MAOB P27338 6/20 0.39
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 3/20 0.37
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
SSTR3 P32745 2/20 0.34
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL27010655 0.91 ALDH1A1 (0.39) KDM1AMAOAMAOBALDH1A1KDM4E
SCHEMBL26620804 0.82 ALDH1A1 (0.41) KDM1AMAOAMAOBALDH1A1KDM4E
SCHEMBL27010657 0.78 ALDH1A1 (0.36) KDM1AMAOAMAOBALDH1A1KDM4E
SCHEMBL26620805 0.76 ALDH1A1 (0.39) KDM1AMAOAMAOBALDH1A1KDM4E
SCHEMBL27010653 0.68 TRPV3 (0.39) KDM1AMAOAMAOBALDH1A1KDM4E
SCHEMBL27010696 0.68 SLC18A3 (0.35)
SCHEMBL30674935 0.67 ALDH1A1 (0.42) ALDH1A1KDM4ETSHRPOLBMEN1
SCHEMBL27414693 0.67 TUBB4A (0.38) KDM4E
SCHEMBL24316213 0.67 TSHR (0.43) ALDH1A1KDM4ELMNATSHRSSTR3
SCHEMBL27010659 0.65 KDM1A (0.47) KDM1AMAOAMAOBALDH1A1KDM4E

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
WO-2022081925-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed
US-9585884-B2 Pyrimidinone inhibitors of lipoprotein-associated phospholipase A2 AUSPEX PHARMACEUTICALS, INC. (US) 2017-03-07 US disclosed