SCHEMBL669634

SCHEMBL669634

CC1(C)CC(C(CC(=O)O)C(=O)O)CC(C)(C)N1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
CPN1 P15169 3/20 0.36
CPB2 Q96IY4 3/20 0.36
POLB P06746 2/20 0.35
GAA P10253 3/20 0.34
EZH2 Q15910 1/20 0.34
CYP1A2 P05177 2/20 0.33
TSHR P16473 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL669633 1.00 HTT (0.39) HTTCPN1CPB2POLBGAA
SCHEMBL11862121 0.84 HTT (0.37) HTTCPN1CPB2POLBGAA
SCHEMBL7768598 0.83 CYP1A2 (0.37) HTTCPN1CPB2POLBGAA
SCHEMBL818892 0.81 GAA (0.44) HTTPOLBGAATSHR
SCHEMBL6310021 0.78 GSTK1 (0.39) HTTTSHRKMT2AALDH1A1TDP1
SCHEMBL28164309 0.78 GSTK1 (0.39) HTTTSHRKMT2AALDH1A1TDP1
SCHEMBL11294043 0.78 GSTK1 (0.39) HTTTSHRKMT2AALDH1A1TDP1
SCHEMBL825542 0.78 GSTK1 (0.39) HTTTSHRKMT2AALDH1A1TDP1
SCHEMBL7187151 0.77 GAA (0.33) CPN1CPB2GAACYP1A2TSHR
SCHEMBL19137894 0.76 GPR84 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4590786-A1 POLYMERISABLE LIQUID CRYSTAL MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM Merck Patent GmbH (DE) 2025-07-30 EP disclosed
EP-4536775-A1 POLYMERISABLE LIQUID CRYSTAL MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM Merck Patent GmbH (DE) 2025-04-16 EP disclosed
WO-2024061796-A1 POLYMERISABLE LIQUID CRYSTAL MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-03-28 WO disclosed
WO-2023237572-A1 POLYMERISABLE LIQUID CRYSTAL MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2023-12-14 WO disclosed
WO-2023227472-A1 POLYCARBONATE COMPOSITION CONTAINING COMBINATION OF HYDROXYPHENYL TRIAZINES AND UV ABSORBERS BASF SE (DE) 2023-11-30 WO disclosed
CN-107207544-A Phosphorous acid compound, process for producing the same, and use thereof 住友化学株式会社 2017-09-26 CN disclosed
CN-107207548-A Bi-ester of phosphite, its manufacture method and its purposes 住友化学株式会社 2017-09-26 CN disclosed
EP-2605647-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATIVE GROWTH IN CROPS Gowan Comercio International e Servicios L (PT) 2013-06-26 EP disclosed
WO-2012024297-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATIVE GROWTH IN CROPS GOWAN COMERCIO INTERNACIONAL E SERVICOS LIMITADA (PT) 2012-02-23 WO disclosed