SCHEMBL2347654

SCHEMBL2347654

ClC1(Cl)CC1(Br)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.43
MAOB P27338 7/20 0.43
ALDH1A1 P00352 2/20 0.37
TRPA1 O75762 1/20 0.37
TSHR P16473 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
KDM1A O60341 6/20 0.36
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35
CALM1 P0DP23 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 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
SCHEMBL2352211 0.82 MAOA (0.46) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL6154075 0.82 MAOA (0.46) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL9143534 0.73 MAOA (0.46) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL1170560 0.67 MAOB (0.50) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL28161193 0.65 MAOA (0.48) MAOAMAOBKDM1ANPSR1CALM1
SCHEMBL27427866 0.65 MAOA (0.48) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL4483495 0.65 MAOA (0.43) MAOAMAOBALDH1A1TRPA1TSHR
SCHEMBL27812156 0.65 MAOA (0.48) MAOAMAOBALDH1A1TRPA1TSHR
Hydrochloric Acid SCHEMBL28767976 0.64 MAOA (0.47) MAOAMAOBALDH1A1SIGMAR1KDM1A
SCHEMBL2810084 0.64 MAOA (0.52) MAOAMAOBALDH1A1TRPA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190137-A1 METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS JACOBSON RICHARD MARTIN 2011-08-04 US disclosed
EP-1409440-A4 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM & HAAS (US) 2005-09-14 EP disclosed
US-20050065033-A1 Method to inhibit ethylene responses in plants JACOBSON RICHARD MARTIN (US) 2005-03-24 US disclosed
EP-1409440-A1 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM AND HAAS COMPANY (US) 2004-04-21 EP disclosed
WO-2002068367-A1 A METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ROHM AND HAAS COMPANY (US) 2002-09-06 WO 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 (2 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-20050065033-A1 Method to inhibit ethylene responses in plants ERN1, CTH, CBS MAOA 1833/4885MAOB 789/4885ALDH1A1 4370/4885
US-20110190137-A1 METHOD TO INHIBIT ETHYLENE RESPONSES IN PLANTS ERN1, CTH, CBR3 MAOA 1685/4885MAOB 736/4885ALDH1A1 4363/4885

“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.