SCHEMBL30958208

SCHEMBL30958208

CN(C)CCCNc1nc(CN2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.49
▸ EHMT2 Q96KQ7 2/20 0.49
▸ RCOR1 Q9UKL0 1/20 0.49
▸ SLC2A1 P11166 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ TERT O14746 3/20 0.45
▸ RAD52 P43351 4/20 0.44
▸ KMT5A Q9NQR1 1/20 0.44
▸ POLB P06746 3/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ ACKR3 P25106 2/20 0.44
▸ TOP2A P11388 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ CHRM4 P08173 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ FLT3 P36888 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL30958288 0.95 KDM1A (0.46) KDM1AEHMT2RCOR1SLC2A1ALDH1A1
SCHEMBL14585376 0.87 KDM1A (0.52) KDM1AEHMT2SLC2A1ALDH1A1MAPK1
SCHEMBL14585526 0.87 KDM1A (0.48) KDM1AEHMT2SLC2A1ALDH1A1MAPK1
SCHEMBL14628129 0.86 KDM1A (0.51) KDM1AEHMT2SLC2A1ALDH1A1MAPK1
SCHEMBL14585377 0.85 ALDH1A1 (0.52) KDM1AEHMT2RCOR1SLC2A1ALDH1A1
SCHEMBL14585382 0.84 KDM1A (0.53) KDM1AEHMT2RCOR1SLC2A1ALDH1A1
SCHEMBL14585528 0.84 FAAH (0.53) KDM1AEHMT2ALDH1A1MAPK1TERT
SCHEMBL14585393 0.84 KDM1A (0.53) KDM1AEHMT2SLC2A1ALDH1A1MAPK1
SCHEMBL14585386 0.84 KDM1A (0.49) KDM1AEHMT2SLC2A1ALDH1A1MAPK1
SCHEMBL14585523 0.84 KDM1A (0.49) KDM1AEHMT2SLC2A1ALDH1A1MAPK1

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-2024112611-A1 TARGETED PROTEIN MODIFICATION WEATHERWAX BIOTECHNOLOGIES CORPORATION (US) 2024-05-30 — — WO disclosed
Send feedback