SCHEMBL31373271

SCHEMBL31373271

Cl[n+]1ccccc1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.46
TP53 P04637 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37
KCNH2 Q12809 1/20 0.36
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
BCL2 P10415 1/20 0.34
BCL2L1 Q07817 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LTA4H P09960 2/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
IDH1 O75874 1/20 0.32
HTR2A P28223 1/20 0.32

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
Hydrochloric Acid SCHEMBL31373256 0.98 CALM1 (0.44) CALM1TP53LOXL2KCNH2APOBEC3A
SCHEMBL2727907 0.78 ALDH1A1 (0.50) CALM1TP53KCNH2APOBEC3AAPOBEC3G
Bromide SCHEMBL28254649 0.72 CALM1 (0.44) CALM1TP53KCNH2APOBEC3AAPOBEC3G
Hydrochloric Acid SCHEMBL2006410 0.72 CALM1 (0.44) CALM1TP53KCNH2APOBEC3AAPOBEC3G
SCHEMBL14740720 0.72 CALM1 (0.44) CALM1TP53LOXL2KCNH2APOBEC3A
Bromide SCHEMBL10904035 0.71 TP53 (0.39) TP53ALDH1A1
SCHEMBL6423133 0.71 CA2 (0.39) CALM1KCNH2ALDH1A1LMNAMEN1
Hydrochloric Acid SCHEMBL11725090 0.71 KDM4E (0.45) CALM1ALDH1A1LMNAMEN1HPGD
SCHEMBL17130344 0.71 TP53 (0.44) CALM1TP53KCNH2APOBEC3AAPOBEC3G
Bromide SCHEMBL11215458 0.71 CALM1 (0.42) CALM1TP53LOXL2KCNH2APOBEC3A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119185090-A High-moisturizing-performance cream, preparation method thereof and cream tissue 珠海金鸡化工有限公司 2024-12-27 CN claimed
CN-119185090-A High-moisturizing-performance cream, preparation method thereof and cream tissue 珠海金鸡化工有限公司 2024-12-27 CN disclosed
CN-119185090-A High-moisturizing-performance cream, preparation method thereof and cream tissue 珠海金鸡化工有限公司 2024-12-27 CN disclosed