SCHEMBL7436894

SCHEMBL7436894

CC1C(c2ccc(Cl)cc2Cl)CC(=O)N1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 3/20 0.43
TSHR P16473 2/20 0.43
AGTR1 P30556 1/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 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
SCHEMBL7441140 0.70 GAA (0.45) DPP4KMT2AMEN1GAATSHR
SCHEMBL7438093 0.70 KDM4E (0.48) DPP4KMT2AMEN1GAATSHR
SCHEMBL13698267 0.67 KMT2A (0.49) KMT2AMEN1TSHRALDH1A1SMN1; SMN2
SCHEMBL1586035 0.66 DPP4 (0.54) DPP4KMT2AMEN1GAATSHR
SCHEMBL17103896 0.64 MEN1 (0.50) DPP4KMT2AMEN1GAATSHR
SCHEMBL30468902 0.64 MEN1 (0.50) DPP4KMT2AMEN1GAATSHR
SCHEMBL17103897 0.64 MEN1 (0.50) DPP4KMT2AMEN1GAATSHR
SCHEMBL22855046 0.63 HTR2A (0.61) DPP4HTR2AHTR2CHTR2B
SCHEMBL5336238 0.63 TP53 (0.62) GAATSHRAGTR1ALDH1A1HTT
SCHEMBL11211107 0.63 HTR2A (0.47) DPP4KMT2AMEN1GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0526535-B1 CYCLIC HYDROXAMIC ACIDS AND THEIR USE ORION YHTYMAE OY (FI) 1995-09-27 EP disclosed
US-5356923-A 1-hydroxy-4(3-cyclopentyloxy-4-methoxyphenyl)-2-pyrrolidone and anti-hypertensive use thereof ORION-YHTYMA OY (FI) 1994-10-18 US disclosed
EP-0526535-A1 CYCLIC HYDROXAMIC ACIDS AND THEIR USE. ORION YHTYMAE OY (FI) 1993-02-10 EP disclosed
WO-1991016303-A1 CYCLIC HYDROXAMIC ACIDS AND THEIR USE Orion-Yhtymä Oy (FI) 1991-10-31 WO disclosed