SCHEMBL5061307

SCHEMBL5061307

Cc1cc(C)c(-c2cc3ccccc3o2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.49
MAOA P21397 3/20 0.49
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
F2RL3 Q96RI0 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2A6 P11509 1/20 0.44
ADRA2A P08913 2/20 0.44
METAP2 P50579 1/20 0.44
GRM4 Q14833 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
IKBKB O14920 1/20 0.42
PDE4D Q08499 1/20 0.41
CYP19A1 P11511 1/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL11672616 0.78 MAOB (0.56) MAOBMAOAPOLBKMT2AMEN1
SCHEMBL18984965 0.76 MAOB (0.62) MAOBMAOAPOLBKMT2AMEN1
SCHEMBL21472147 0.76 MAOB (0.54) MAOBMAOAKMT2AMEN1ADRA2A
SCHEMBL13909074 0.73 MAOB (0.50) MAOBMAOAPOLBKMT2AMEN1
SCHEMBL21473052 0.72 MAOB (0.53) MAOBMAOAKMT2AMEN1F2RL3
SCHEMBL29225183 0.72 MAOB (0.49) MAOBMAOAKMT2AMEN1F2RL3
SCHEMBL30463541 0.72 MAOB (0.49) MAOBMAOAKMT2AMEN1F2RL3
SCHEMBL30463566 0.72 MAOB (0.49) MAOBMAOAPOLBKMT2AMEN1
SCHEMBL29224940 0.72 MAOB (0.49) MAOBMAOAPOLBKMT2AMEN1
SCHEMBL12854020 0.72 MAOB (0.71) MAOBMAOAPOLBKMT2AMEN1

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-20080269225-A1 Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-30 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-20080269225-A1 Prokineticin 1 receptor antagonists PROKR1, PROKR2, GIPR MAOB 2669/4885MAOA 2926/4885POLB 3963/4885

“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.