SCHEMBL31228987

SCHEMBL31228987

CCCCC(CC)Cc1cc(CC(CC)CCCC)c(CN(C)C)cc1CN(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.38
TDP1 Q9NUW8 3/20 0.38
CYP3A4 P08684 6/20 0.37
TSHR P16473 5/20 0.37
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
G6PD P11413 1/20 0.34
PABPC1 P11940 1/20 0.34
KMT2A Q03164 1/20 0.34
HKDC1 Q2TB90 1/20 0.34
CA2 P00918 3/20 0.33
MAPK1 P28482 1/20 0.32
GLA P06280 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
SCHEMBL1776251 0.77 BDKRB2 (0.41) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL1040922 0.77 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL1261390 0.73 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL15738357 0.73 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL11681110 0.72 ALDH1A1 (0.55) ALDH1A1CYP3A4TSHRLMNAHSD17B10
SCHEMBL29385746 0.72 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL153633 0.72 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL11331262 0.71 ALDH1A1 (0.44) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL15307383 0.71 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4TSHRLMNA
SCHEMBL11039409 0.70 TYR (0.57) ALDH1A1TDP1CYP3A4TSHRLMNA

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-118956250-B High-strength high-weather-resistance elastic coating and preparation method and application thereof 天津森聚柯密封涂层材料有限公司 2025-01-03 CN disclosed
CN-118956250-A High-strength high-weather-resistance elastic coating and preparation method and application thereof 天津森聚柯密封涂层材料有限公司 2024-11-15 CN disclosed