SCHEMBL26037956

SCHEMBL26037956

Cc1nc(N2CCN(C)CC2)nc(C)c1N

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 15/20 0.61
▸ KMT2A Q03164 1/20 0.51
▸ HTR3A P46098 1/20 0.49

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
SCHEMBL26580968 0.83 HRH4 (0.55) HRH4KMT2AHTR3A
SCHEMBL27082996 0.79 HRH4 (0.59) HRH4KMT2AHTR3A
SCHEMBL20604725 0.79 KMT2A (0.56) HRH4KMT2A
SCHEMBL5032275 0.78 HRH4 (0.78) HRH4
SCHEMBL3094653 0.78 ALDH1A1 (0.56) HRH4KMT2A
SCHEMBL23809147 0.76 HRH4 (0.53) HRH4KMT2A
SCHEMBL4369596 0.76 HRH4 (1.00) HRH4
SCHEMBL22924654 0.76 HRH4 (0.74) HRH4KMT2AHTR3A
SCHEMBL12257800 0.76 HRH4 (0.74) HRH4KMT2AHTR3A
SCHEMBL20604872 0.75 HRH4 (0.47) HRH4KMT2AHTR3A

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-3423435-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2023-08-23 — — EP disclosed
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