SCHEMBL5474666

SCHEMBL5474666

NC(=O)NC1(O)CCCc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.43
HDAC9 Q9UKV0 1/20 0.42
AKR1B1 P15121 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL10637900 0.81 KDM1A (0.46) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL7272186 0.81 ALDH1A1 (0.44) KDM1AHDAC9AKR1B1KMT2ASIGMAR1
SCHEMBL10483582 0.77 KDM1A (0.51) KDM1AAKR1B1MEN1KMT2ASIGMAR1
SCHEMBL9501252 0.76 KDM1A (0.41) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL28136912 0.74 KDM1A (0.45) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL28268458 0.72 KDM1A (0.43) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL10998922 0.72 HDAC9 (0.46) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL11421572 0.72 HDAC9 (0.43) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL15848044 0.71 KDM1A (0.53) KDM1AHDAC9AKR1B1MEN1KMT2A
SCHEMBL6440070 0.71 KDM1A (0.56) KDM1AAKR1B1MEN1KMT2ASIGMAR1

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-20070027187-A1 Hydroxy-tetrahydro-naphthalenylurea derivatives BAYER HEALTHCARE AG (DE) 2007-02-01 US claimed

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-20070027187-A1 Hydroxy-tetrahydro-naphthalenylurea derivatives HVCN1, NMUR1, OPRL1 KDM1A 2074/4885HDAC9 3182/4885AKR1B1 1029/4885

“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.