SCHEMBL8901801

SCHEMBL8901801

Cc1ccccc1-c1c(O)c(C(C)C)nn(Cc2ccccc2Cl)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.43
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
BLM P54132 1/20 0.41
GPR35 Q9HC97 1/20 0.41
MAPT P10636 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 1/20 0.39
CHRM1 P11229 1/20 0.39
P2RX7 Q99572 1/20 0.38
PTGER3 P43115 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL8902477 0.89 TACR1 (0.44) TACR1GAASMN1; SMN2KMT2AMEN1
SCHEMBL8902396 0.87 GAA (0.50) TACR1GAASMN1; SMN2KMT2AMEN1
SCHEMBL8902971 0.86 PDE5A (0.44) TACR1KMT2AMEN1POLBTDP1
SCHEMBL8902542 0.86 GAA (0.40) TACR1GAASMN1; SMN2KMT2AMEN1
SCHEMBL8901922 0.85 LMNA (0.41) SMN1; SMN2KMT2AMEN1NPSR1MAPT
SCHEMBL8902381 0.84 GAA (0.42) TACR1GAASMN1; SMN2KMT2AMEN1
SCHEMBL8902474 0.83 GAA (0.41) TACR1GAASMN1; SMN2KMT2AMEN1
SCHEMBL11965018 0.82 MAPT (0.36) TACR1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL8901852 0.82 IDO1 (0.45) SMN1; SMN2KMT2AMEN1MAPTTDP1
SCHEMBL11965014 0.80 PTGS2 (0.38) TACR1GAASMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188008-B2 Herbicidally and insecticidally active 4-phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-05-29 US disclosed
US-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-08 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-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX4, PRDX1 TACR1 1742/4885GAA 861/4885SMN1; SMN2 3551/4885

“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.