SCHEMBL8059604

SCHEMBL8059604

Fc1ccccc1Oc1c[c]ncn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAP4K4 O95819 1/20 0.43
MRGPRX1 Q96LB2 6/20 0.39
ALDH1A1 P00352 1/20 0.37
ESR1 P03372 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
DCK P27707 1/20 0.34
HTR1A P08908 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
PARP10 Q53GL7 1/20 0.34
CXCL8 P10145 1/20 0.34

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
SCHEMBL8174603 0.81 SLC6A2 (0.32) HTR1ASLC6A2
SCHEMBL8062064 0.80 ALDH1A1 (0.47) MEN1KMT2AMAP4K4ALDH1A1LMNA
SCHEMBL8176365 0.80 SMN1; SMN2 (0.53) MEN1KMT2AMAP4K4MRGPRX1ALDH1A1
SCHEMBL468017 0.76 MAP4K4 (0.47) MAP4K4ALDH1A1SMN1; SMN2DCK
SCHEMBL17764755 0.76 MEN1 (0.45) MEN1KMT2AMRGPRX1ALDH1A1KDM4E
SCHEMBL6773239 0.75 SMN1; SMN2 (0.47) MEN1KMT2AMAP4K4ALDH1A1MAPT
SCHEMBL16541082 0.75 MEN1 (0.53) MEN1KMT2AMAP4K4MRGPRX1ALDH1A1
SCHEMBL12825388 0.71 MEN1 (0.49) MEN1KMT2AMAP4K4MRGPRX1ALDH1A1
SCHEMBL307909 0.71 MEN1 (0.49) MEN1KMT2AMAP4K4MRGPRX1ALDH1A1
SCHEMBL2044641 0.70 MEN1 (0.59) MEN1KMT2AMAP4K4MRGPRX1ALDH1A1

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
EP-1015412-A1 SUBSTITUTED ALKENOIC ACIDS AND THEIR DERIVATIVES BAYER AG (DE) 2000-07-05 EP disclosed
EP-1015420-A1 SUBSTITUTED ALKENOIC ACIDS AND THEIR DERIVATIVES BAYER AG (DE) 2000-07-05 EP disclosed
US-6075148-A CARBAMATE DERIVATIVES ARE USEFUL FOR CONTROLLING FUNGI, INSECTS, NEMATODES AND SPIDER MITES BASF AKTIENGESELLSCHAFT (DE) 2000-06-13 US disclosed
US-5981532-A FOR CONTROLLING FUNGI, INSECTS, NEMATODES AND SPIDER MITES BASF AKTIENGESELLSCHAFT (DE) 1999-11-09 US disclosed
WO-1999012892-A1 SUBSTITUTED ALKENOIC ACIDS AND THEIR DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1999-03-18 WO disclosed
WO-1999012885-A1 SUBSTITUTED ALKENOIC ACIDS AND THEIR DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1999-03-18 WO disclosed