SCHEMBL3525807

SCHEMBL3525807

CNc1ccc(Br)cc1C(=O)NC1C(C)(c2ccccc2)c2ccc(OCc3ccncc3)cc2N(C(C)=O)C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FSHR P23945 1/20 0.38
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
PTGES O14684 1/20 0.35
LRRK2 Q5S007 7/20 0.34
F10 P00742 1/20 0.33
GPR132 Q9UNW8 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ALK Q9UM73 1/20 0.32
NOX1 Q9Y5S8 1/20 0.32
ADAM17 P78536 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL3529784 0.73 FSHR (0.48) FSHRLRRK2MEN1KMT2A
SCHEMBL4217129 0.63 AKR1C2 (0.54) PTGESAKR1C2AKR1C1MEN1KMT2A
SCHEMBL6353185 0.63 AKR1C2 (0.72) LMNAGPR132AKR1C2AKR1C1MEN1
SCHEMBL1322915 0.61 FSHR (0.69) FSHRMEN1KMT2A
SCHEMBL3527025 0.61 FSHR (0.56) FSHRMEN1KMT2A
SCHEMBL4373972 0.60 MAPT (0.36) POLBLMNAAKR1C2AKR1C1KMT2A
SCHEMBL6821934 0.59 AKR1C2 (0.53) PTGESLRRK2AKR1C2AKR1C1MEN1
SCHEMBL1714879 0.59 CDC7 (0.47) POLBLMNALRRK2MEN1KMT2A
SCHEMBL6818679 0.59 ALDH1A1 (0.52) POLBLMNAPTGESLRRK2AKR1C2
SCHEMBL4369531 0.59 FSHR (0.58) FSHRMEN1KMT2AMAPT

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-7858794-B2 Tetrahydroquinoline derivatives N.V. ORGANON (NL) 2010-12-28 US disclosed
US-20060142334-A1 Tetrahydroquinoline derivatives MERCK SHARP & DOHME B.V. (NL) 2006-06-29 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-20060142334-A1 Tetrahydroquinoline derivatives GNRHR, KCNH3, HCAR3 FSHR 9/4885POLB 3243/4885LMNA 2156/4885

“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.