SCHEMBL9561997

SCHEMBL9561997

CCC[C@H]1CC[C@H](COc2cccc(F)c2F)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.46
KDM4C Q9H3R0 1/20 0.39
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 3/20 0.39
SLC6A3 Q01959 2/20 0.39
KCNN4 O15554 1/20 0.39
HTR2C P28335 5/20 0.38
HTR2B P41595 4/20 0.38
HTR7 P34969 2/20 0.38
HTR3A P46098 2/20 0.38
HTR4 Q13639 2/20 0.38
METAP2 P50579 1/20 0.37
DGAT1 O75907 1/20 0.37
HTR1A P08908 3/20 0.37
HTR2A P28223 2/20 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
SCHEMBL9561995 1.00 RIPK1 (0.46) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL15722920 0.96 RIPK1 (0.43) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL2861453 0.90 RIPK1 (0.43) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL2861452 0.90 RIPK1 (0.43) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL30209609 0.90 RIPK1 (0.43) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL15969381 0.89 RIPK1 (0.46) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL2261643 0.88 RIPK1 (0.44) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL2261640 0.88 RIPK1 (0.44) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL10091219 0.85 RIPK1 (0.44) RIPK1KDM4CSLC6A2SLC6A4SLC6A3
SCHEMBL19753098 0.84 RIPK1 (0.48) RIPK1KCNN4HTR2CHTR2BHTR7

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
CN-113881442-B Liquid crystal compound containing polyfluornonaphthalene and preparation method thereof 宁夏中星显示材料有限公司 2023-02-03 CN disclosed
CN-113881442-A Liquid crystal compound containing polyfluornonaphthalene and preparation method thereof 宁夏中星显示材料有限公司 2022-01-04 CN disclosed
EP-0357727-B1 2,3-DIFLUOROBENZENE DERIVATIVES AND THEIR USE AS COMPONENTS OF LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 1993-11-24 EP disclosed
US-5236620-A 2,3-DIFLUOROBENZENE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-08-17 US disclosed
EP-0364538-B1 DIFLUOROBENZOL DERIVATIVES MERCK PATENT GmbH (DE) 1992-05-06 EP disclosed
EP-0364538-A1 DIFLUOROBENZOL DERIVATIVES. MERCK PATENT GMBH (DE) 1990-04-25 EP disclosed
EP-0357727-A1 2,3-DIFLUOROBENZENE DERIVATIVES AND THEIR USE AS COMPONENTS OF LIQUID CRYSTAL MEDIA. MERCK PATENT GMBH (DE) 1990-03-14 EP disclosed
WO-1989008633-A1 DIFLUOROBENZOL DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed
WO-1989008689-A1 2,3-DIFLUOROBENZENE DERIVATIVES AND THEIR USE AS COMPONENTS OF LIQUID CRYSTAL MEDIA MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed