SCHEMBL10480342

SCHEMBL10480342

c1ccc(NC2CCCCCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.53
GAA P10253 4/20 0.53
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
RAB9A P51151 2/20 0.53
EPHX1 P07099 2/20 0.53
EPHX2 P34913 1/20 0.53
LMNA P02545 3/20 0.50
HSD17B10 Q99714 2/20 0.50
NPY5R Q15761 1/20 0.50
POLB P06746 1/20 0.50
MEN1 O00255 2/20 0.47
MAPK1 P28482 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
IDO1 P14902 1/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL18639265 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL29594018 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL285479 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL24198978 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL1485904 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL24514268 1.00 KDM4E (0.53) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL17822068 0.98 KDM4E (0.52) KDM4EGAAMAPTSMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL7002314 0.98 KDM4E (0.52) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL1425186 0.98 KDM4E (0.52) KDM4EGAAMAPTSMN1; SMN2RAB9A
SCHEMBL17822021 0.96 GAA (0.50) KDM4EGAAMAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730980-A Compound and stereoisomer thereof, or pharmaceutically acceptable salt and application thereof 合肥工业大学智能制造技术研究院 2023-09-12 CN disclosed
CN-108840824-A The preparation process of 4- phenyl cycloheptylamine 遵义医学院附属医院 2018-11-20 CN disclosed
WO-1989009209-A1 PIPERIDINE RING MODIFIED PHENCYCLIDINE ANALOGS AS ANTICONVULSANTS MARION LABORATORIES, INC. (US) 1989-10-05 WO disclosed