SCHEMBL3287232

SCHEMBL3287232

N#Cc1cccc(Oc2ccc(Cl)cn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.50
HRH3 Q9Y5N1 3/20 0.49
KCNH2 Q12809 1/20 0.45
CYP19A1 P11511 1/20 0.45
PTGER4 P35408 1/20 0.42
PTGER2 P43116 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
BRCA1 P38398 1/20 0.41
HBB P68871 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
JAK3 P52333 1/20 0.41
MLNR O43193 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
PPARG P37231 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL30005667 1.00 MAP4K4 (0.50) MAP4K4HRH3KCNH2CYP19A1PTGER4
SCHEMBL5259575 0.92 HRH3 (0.47) MAP4K4HRH3KCNH2CYP19A1PTGER4
SCHEMBL29123563 0.82 MAP4K4 (0.53) MAP4K4HRH3KCNH2CYP19A1KDM4E
SCHEMBL30006982 0.82 MAP4K4 (0.53) MAP4K4HRH3KCNH2CYP19A1KDM4E
SCHEMBL3289972 0.82 HRH3 (0.52) MAP4K4HRH3KCNH2KDM4EMEN1
SCHEMBL16827325 0.81 P2RX3 (0.47) MAP4K4CYP19A1PDE4BLIPE
SCHEMBL24664166 0.79 MAPK1 (0.62) MAP4K4HRH3KCNH2ALDH1A1KMT2A
SCHEMBL3163774 0.79 ALDH1A1 (0.61) MAP4K4HRH3KCNH2KDM4EMEN1
SCHEMBL3173071 0.79 HRH3 (0.49) MAP4K4HRH3KCNH2KDM4EMEN1
SCHEMBL30731743 0.79 MAPK1 (0.62) MAP4K4HRH3KCNH2ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117015537-A Heteroaryl aminopropanol derivatives as inhibitors of LTA4H 诺华股份有限公司 2023-11-07 CN disclosed
WO-2022219546-A1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H NOVARTIS AG (CH) 2022-10-20 WO disclosed
US-8546374-B2 Amino-tetrazoles analogues and methods of use ABBVIE INC. (US) 2013-10-01 US disclosed
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2012-12-27 US disclosed
US-8217067-B2 Antiinflammatory agents, antidepressants, analgesics, purinergic receptor antagonists; neurodegenerative diseases, spinal cord injuries; 1-(2,3-dichlorophenyl)-N-[(2-methylphenyl)methyl]-1H-tetraazol-5-amine ABBOTT LABORATORIES (US) 2012-07-10 US disclosed
US-7723367-B2 Amino-tetrazoles analogues and methods of use ABBOTT LABORATORIES (US) 2010-05-25 US disclosed
US-7704997-B1 Amino-tetrazole analogues and methods of use ABBOTT LABORATORIES (US) 2010-04-27 US disclosed
US-20080171733-A1 Amino-Tetrazoles Analogues and Methods of Use ABBOTT LABORATORIES (US) 2008-07-17 US disclosed
US-20070049584-A1 Amino-tetrazoles analogues and methods of use ABBVIE INC. 2007-03-01 US disclosed
US-20060052374-A1 Amino-tetrazole analogues and methods of use ABBVIE INC. 2006-03-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080171733-A1 Amino-Tetrazoles Analogues and Methods of Use P2RX7, P2RX2, P2RX5 MAP4K4 3196/4885HRH3 231/4885KCNH2 333/4885
US-20120329772-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE P2RX7, P2RX2, P2RX5 MAP4K4 3196/4885HRH3 231/4885KCNH2 333/4885
US-20070049584-A1 Amino-tetrazoles analogues and methods of use P2RX7, P2RX2, P2RX5 MAP4K4 3196/4885HRH3 231/4885KCNH2 333/4885
US-20060052374-A1 Amino-tetrazole analogues and methods of use P2RX7, P2RX2, P2RX3 MAP4K4 3318/4885HRH3 191/4885KCNH2 281/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.