SCHEMBL8845495

SCHEMBL8845495

CN(C)CCOc1ccc(C2C(c3ccccc3)C2(Cl)Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.58
LSS P48449 1/20 0.49
HRH3 Q9Y5N1 1/20 0.47
HTR6 P50406 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 3/20 0.47
ESR1 P03372 3/20 0.47
CYP2D6 P10635 2/20 0.47
ESR2 Q92731 2/20 0.47
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
NR1I2 O75469 1/20 0.47
PRKD3 O94806 1/20 0.47
ABCB11 O95342 1/20 0.47
EGFR P00533 1/20 0.47
GBA1 P04062 1/20 0.47
NR3C1 P04150 1/20 0.47
ERBB2 P04626 1/20 0.47

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
Hydrochloric Acid SCHEMBL10574784 0.99 LTA4H (0.56) LTA4HLSSHRH3HTR6LMNA
SCHEMBL11061377 0.94 HRH3 (0.53) LTA4HHRH3MAPTKDM4EESR1
Hydrochloric Acid SCHEMBL11061505 0.92 HRH3 (0.51) LTA4HHRH3MAPTKDM4EESR1
SCHEMBL11057521 0.91 LTA4H (0.49) LTA4HHRH3HTR6LMNAMAPT
Sulfuric Acid SCHEMBL11060751 0.86 HRH3 (0.48) LTA4HHRH3MAPTKDM4EESR1
SCHEMBL8845624 0.86 HTT (0.57) LTA4HHRH3HTR6MAPTKDM4E
SCHEMBL8845562 0.82 MEN1 (0.43) LTA4HHRH3LMNAMAPTKDM4E
SCHEMBL22595039 0.81 LTA4H (0.52) LTA4HLSSHRH3HTR6LMNA
SCHEMBL8845580 0.80 ALDH1A1 (0.56) MAPTMEN1NR1I2CYP3A4DRD2
SCHEMBL8915518 0.80 LTA4H (0.55) LTA4HLSSHRH3HTR6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5658914-A ANTIESTROGENS, ANTITUMOR AGENTS RESEARCH CORPORATION TECHNOLOGIES (US) 1997-08-19 US disclosed
US-5658951-A ANTIESTROGENS, ANTITUMOR AGENTS RESEARCH CORPORATION TECHNOLOGIES (US) 1997-08-19 US disclosed
US-5658927-A ANTIESTROGENS, ANTITUMOR AGENTS RESEARCH CORPORATION TECHNOLOGIES (US) 1997-08-19 US disclosed
US-5422367-A A hormon inhibitors and for inhibiting the development of an estrogen-dependent tumor RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-06-06 US disclosed
US-5324736-A Diphenylcyclopropyl analogs as antiestrogenic and antitumor agents RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1994-06-28 US disclosed
US-5098903-A Halocyclopropanes BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 1992-03-24 US disclosed