SCHEMBL26149604

SCHEMBL26149604

Ic1cccc(CN2CCCCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.64
ALDH1A1 P00352 3/20 0.64
TDP1 Q9NUW8 1/20 0.64
PRMT6 Q96LA8 1/20 0.61
KDM4E B2RXH2 1/20 0.58
GAA P10253 1/20 0.58
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 1/20 0.57
HIF1A Q16665 1/20 0.57
HRH3 Q9Y5N1 1/20 0.55
SIGMAR1 Q99720 2/20 0.55
CYP2C19 P33261 1/20 0.55
FAAH O00519 1/20 0.52
POLB P06746 1/20 0.51
HTT P42858 1/20 0.51

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
SCHEMBL2225221 0.98 PRMT6 (0.62) SMN1; SMN2ALDH1A1TDP1PRMT6KDM4E
SCHEMBL11192726 0.86 PRMT6 (0.78) SMN1; SMN2ALDH1A1TDP1PRMT6KDM4E
SCHEMBL11339852 0.86 PRMT6 (0.78) SMN1; SMN2ALDH1A1TDP1PRMT6KDM4E
SCHEMBL807251 0.82 NCF1 (0.66) SMN1; SMN2ALDH1A1KDM4EHIF1AHRH3
SCHEMBL18919824 0.82 MEN1 (0.66) SMN1; SMN2ALDH1A1KDM4ESIGMAR1FAAH
SCHEMBL29671335 0.82 MEN1 (0.66) SMN1; SMN2ALDH1A1KDM4ESIGMAR1FAAH
SCHEMBL3720580 0.82 MC4R (0.62) PRMT6HRH3SIGMAR1FAAH
SCHEMBL2923930 0.82 SIGMAR1 (0.62) TDP1HRH3SIGMAR1FAAH
SCHEMBL13382006 0.82 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1TDP1KDM4ESIGMAR1
SCHEMBL18946202 0.80 LMNA (0.62) PRMT6SIGMAR1CYP2C19FAAH

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
CN-120077042-A 3A,4,5, 6-tetrahydro-1H-pyrazolo [3,4-C ] pyridin-7 (7 AH) -one derivatives as factor XIIa inhibitors 卡尔维斯塔制药有限公司 2025-05-30 CN disclosed
WO-2023077216-A1 HEAT SHOCK PROTEIN 90 (HSP90) INHIBITORS FOR TREATING FUNGAL INFECTIONS AND METHODS OF USE THEREOF BRIGHT ANGEL THERAPEUTICS INC. (CA) 2023-05-11 WO disclosed