SCHEMBL10000254

SCHEMBL10000254

Cc1ccc(-c2ccc(-c3ccc(C)cc3)nn2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.61
RAB9A P51151 5/20 0.61
SMN1; SMN2 Q16637 5/20 0.61
LMNA P02545 3/20 0.61
NFKB1 P19838 2/20 0.61
NFKB2 Q00653 2/20 0.61
RELA Q04206 2/20 0.61
KMT2A Q03164 4/20 0.54
POLB P06746 2/20 0.54
NOTUM Q6P988 2/20 0.54
MEN1 O00255 3/20 0.50
METAP2 P50579 1/20 0.48
METAP1 P53582 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
ACHE P22303 1/20 0.47
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
HPGDS O60760 1/20 0.46
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL29105358 0.90 NPC1 (0.57) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL10000239 0.90 NPC1 (0.53) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL30661709 0.90 NPC1 (0.57) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL17051572 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL10000247 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2LMNANFKB1
Ammonia Solution, Strong SCHEMBL28862433 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL11996731 0.86 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL17051533 0.84 NPC1 (0.49) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL13140612 0.84 MAPT (0.49) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL24046966 0.82 SMN1; SMN2 (0.56) NPC1RAB9ASMN1; SMN2LMNANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104667102-B The Preparation method and use of galangal aerial parts volatile oil 深圳清华大学研究院 2018-09-11 CN claimed
CN-104667102-A Preparation method and use of galangal ground part essential oil UNIV TSINGHUA RES INST 2015-06-03 CN claimed
CN-104667102-B The Preparation method and use of galangal aerial parts volatile oil 深圳清华大学研究院 2018-09-11 CN disclosed
CN-104667102-A Preparation method and use of galangal ground part essential oil UNIV TSINGHUA RES INST 2015-06-03 CN disclosed
US-8158020-B2 Liquid crystal element, optical path deflecting element, and image displaying apparatus RICOH COMPANY, LTD. (JP) 2012-04-17 US disclosed
US-8158020-B2 Liquid crystal element, optical path deflecting element, and image displaying apparatus RICOH COMPANY, LTD. (JP) 2012-04-17 US disclosed
US-20080204608-A1 Liquid Crystal Element, Optical Path Deflecting Element, and Image Displaying Apparatus RICOH COMPANY, LTD. (JP) 2008-08-28 US disclosed
US-20080204608-A1 Liquid Crystal Element, Optical Path Deflecting Element, and Image Displaying Apparatus RICOH COMPANY, LTD. (JP) 2008-08-28 US disclosed