SCHEMBL29028762

SCHEMBL29028762

CCNN(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
GAA P10253 2/20 0.42
HTT P42858 2/20 0.42
ALOX12 P18054 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
TSHR P16473 2/20 0.40
GLA P06280 1/20 0.40
KCNN4 O15554 1/20 0.38
TP53 P04637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL6666470 0.80 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL8861782 0.78 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AHTTTSHR
Hydrochloric Acid SCHEMBL11760178 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL8508810 0.78 CYP2D6 (0.41) ALDH1A1SMN1; SMN2TSHRKDM4ECYP2D6
SCHEMBL22444429 0.76 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL7982311 0.76 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL9322422 0.76 HTT (0.51) ALDH1A1MAPTNPSR1GAAHTT
SCHEMBL27627046 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13949305 0.74 TP53 (0.48) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL10388833 0.73 ALDH1A1 (0.42) ALDH1A1MEN1KMT2AMAPTGAA

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
CN-115161795-A Antibacterial fabric and preparation process thereof 广东樱基森实业有限公司 2022-10-11 CN disclosed