SCHEMBL22812969

SCHEMBL22812969

CONc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 1/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ MAPT P10636 3/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ TSHR P16473 1/20 0.53
▸ GPR119 Q8TDV5 4/20 0.53
▸ LMNA P02545 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ F13A1 P00488 1/20 0.48
▸ TGM2 P21980 1/20 0.48
▸ TGM1 P22735 1/20 0.48
▸ NAMPT P43490 1/20 0.48
▸ CYP2C19 P33261 1/20 0.47
▸ CKS1B P61024 1/20 0.47
▸ SKP1 P63208 1/20 0.47
▸ SKP2 Q13309 1/20 0.47
▸ PDK2 Q15119 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL23047380 0.88 WNT3A (0.57) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL6741353 0.88 WNT3A (0.57) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL28907538 0.86 WNT3A (0.63) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL4065096 0.85 WNT3A (0.55) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL30385839 0.84 WNT3A (0.58) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL29020664 0.84 WNT3A (0.58) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL18661912 0.84 WNT3A (0.54) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL4069752 0.84 WNT3A (0.58) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL17675597 0.83 WNT3A (0.62) WNT3ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL27315749 0.83 WNT3A (0.55) WNT3ASMN1; SMN2MAPTMEN1KMT2A

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-3753933-A1 SUCCINATE SALT OF 7-CYCLOPENTYL-2 -(5-PIPERAZIN-1-YL-PYRIDIN-2-YLAMINO)-7H-PYRROLO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID DIMETHYLAMIDE AND PROCESSES OF MAKING THEREOF Novartis AG (CH) 2020-12-23 — — EP disclosed
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