SCHEMBL13698989

SCHEMBL13698989

Cc1ccc2c(c1)CC1(CCN(C)CC1)O2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ATM Q13315 2/20 0.46
HTT P42858 2/20 0.46
HDAC3 O15379 3/20 0.41
HDAC4 P56524 3/20 0.41
HDAC1 Q13547 3/20 0.41
HDAC7 Q8WUI4 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC10 Q969S8 3/20 0.41
HDAC11 Q96DB2 3/20 0.41
HDAC8 Q9BY41 3/20 0.41
HDAC6 Q9UBN7 3/20 0.41
HDAC9 Q9UKV0 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41
DRD2 P14416 1/20 0.39
KMT2A Q03164 3/20 0.37
CCR1 P32246 2/20 0.36
ACACB O00763 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL13698990 0.87 HTR2A (0.43) KDM4EDRD2
SCHEMBL10191702 0.86 HRH3 (0.43) DRD2
SCHEMBL13910958 0.83 KDM4E (0.63) KDM4EATMHTTCCR1ALDH1A1
SCHEMBL26251980 0.83 CCR1 (0.47) DRD2CCR1
SCHEMBL31515327 0.83 HDAC3 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10191634 0.82 HRH3 (0.52)
SCHEMBL4214545 0.81 KDM4E (0.47) KDM4EATMHTTHDAC3HDAC4
SCHEMBL4226642 0.80 SIGMAR1 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL31515227 0.79 HDAC3 (0.48) KDM4EHDAC3HDAC4HDAC1HDAC7
SCHEMBL10191820 0.79 HRH3 (0.49)

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R KDM4E 1604/4885ATM 4406/4885HTT 618/4885

“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.