SCHEMBL3208887

SCHEMBL3208887

[CH2]CCC(Cc1ccccc1)C1=COCO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.37
POLB P06746 2/20 0.33
MEN1 O00255 6/20 0.32
KMT2A Q03164 6/20 0.32
MAPT P10636 4/20 0.32
NPSR1 Q6W5P4 3/20 0.32
MAPK1 P28482 2/20 0.32
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
HTR6 P50406 1/20 0.32
EPHX1 P07099 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PKM P14618 2/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 3/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL406396 0.88 MIF (0.39) MIFPOLBMEN1KMT2AMAPT
SCHEMBL3560110 0.85 MIF (0.37) MIFMEN1KMT2AMAPTNPSR1
SCHEMBL938718 0.81 EPHX1 (0.37) MIFEPHX1PKMALDH1A1CYP2D6
SCHEMBL3748652 0.81 TRPA1 (0.40) MIFEPHX1HPGDSMN1; SMN2PKM
SCHEMBL2471269 0.81 HTR2A (0.39) POLBMEN1KMT2AMAPTNPSR1
SCHEMBL300073 0.81 EPHX1 (0.35) MIFMEN1KMT2AEPHX1PKM
Hydrochloric Acid SCHEMBL3569025 0.80 EPHX1 (0.36) MIFMEN1KMT2AEPHX1PKM
SCHEMBL5073587 0.79 MIF (0.39) MIFMEN1KMT2AMAPTNPSR1
SCHEMBL1430902 0.78 MIF (0.56) MIFKMT2AHPGDSMN1; SMN2PKM
SCHEMBL3558393 0.78 MIF (0.36) MIFPOLBMEN1KMT2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069244-A1 Pyridine Compounds for Combating Pests BASF SE (DE) 2010-03-18 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 (1 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-20100069244-A1 Pyridine Compounds for Combating Pests CHRM1, PRDX1, CHRM2 MIF 4320/4885POLB 4690/4885MEN1 1512/4885

“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.