SCHEMBL31523974

SCHEMBL31523974

CC1CCCN(C)C1(C)C.CC1CCCN(C)C1(C)C.CC1CCCN(C)C1(C)C.[Al]

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL125978 0.98 KDM4E (0.31) KDM4EALDH1A1HSD17B10
Magnesium SCHEMBL31257200 0.95 KDM4E (0.34) KDM4EALDH1A1HSD17B10
Calcium SCHEMBL31257197 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
Rubidium SCHEMBL31257199 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
SCHEMBL18956275 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
SCHEMBL31386632 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL15018678 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL5318480 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
SCHEMBL11741955 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10
Lithium SCHEMBL488986 0.95 KDM4E (0.30) KDM4EALDH1A1HSD17B10

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-119954609-A 2-Iodo-3, 4,5,6-d4Process for the preparation of phenol 广州瑞安博医药科技有限公司 2025-05-09 CN disclosed