SCHEMBL9723752

SCHEMBL9723752

CCCCCCCCCCOc1cccc(-c2ccccc2)c1C(=O)Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.52
PTPN11 Q06124 3/20 0.51
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.50
NR1I2 O75469 1/20 0.50
LMNA P02545 1/20 0.50
CHRM2 P08172 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADRA2A P08913 1/20 0.50
MAPT P10636 1/20 0.50
OPRK1 P41145 1/20 0.50
HTR2B P41595 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
PTPN1 P18031 2/20 0.48
GAA P10253 1/20 0.45

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
SCHEMBL9330868 0.89 PTPN11 (0.56) KDM4EPTPN11ALDH1A1SMN1; SMN2MEN1
SCHEMBL7330160 0.89 PTPN11 (0.56) KDM4EPTPN11ALDH1A1SMN1; SMN2MEN1
SCHEMBL9677245 0.89 PTPN11 (0.56) KDM4EPTPN11ALDH1A1SMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL9723762 0.88 PTPN11 (0.55) KDM4EPTPN11ALDH1A1SMN1; SMN2MEN1
SCHEMBL3975419 0.80 KDM4E (0.53) KDM4EPTPN11ALDH1A1SMN1; SMN2MEN1
SCHEMBL11517468 0.80 TSHR (0.50) ALDH1A1MEN1NR1I2LMNACHRM2
SCHEMBL9715200 0.80 ADRB2 (0.61) KDM4EPTPN11ALDH1A1SMN1; SMN2LMNA
SCHEMBL5969665 0.80 ADRB2 (0.61) KDM4EPTPN11ALDH1A1SMN1; SMN2LMNA
SCHEMBL3826240 0.80 ADRB2 (0.61) KDM4EPTPN11ALDH1A1SMN1; SMN2LMNA
SCHEMBL13739675 0.80 ADRB2 (0.61) KDM4EPTPN11ALDH1A1SMN1; SMN2LMNA

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
US-5114613-A High-speed responsive, stable films; controlling the mesomorphic state and temperature CANON KABUSHIKI KAISHA (JP) 1992-05-19 US disclosed
EP-0354355-A1 Optically active compound and liquid crystal composition MITSUBISHI RAYON CO., LTD. (JP) 1990-02-14 EP disclosed
US-4882085-A Lactic acid derivative and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-11-21 US disclosed