SCHEMBL6404926

SCHEMBL6404926

O=C(N[C@@H]1Cc2ccc(CCCl)cc2C1)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.49
CA2 P00918 5/20 0.49
CA12 O43570 4/20 0.49
CA7 P43166 4/20 0.49
CA14 Q9ULX7 4/20 0.49
CA9 Q16790 3/20 0.49
GRM7 Q14831 1/20 0.41
ACKR3 P25106 1/20 0.39
EPHX2 P34913 1/20 0.39
TBXA2R P21731 2/20 0.39
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
MCHR1 Q99705 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 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
SCHEMBL6399881 1.00 CA1 (0.49) CA1CA2CA12CA7CA14
SCHEMBL5740874 0.84 CA1 (0.57) CA1CA2CA12CA7CA14
SCHEMBL5739723 0.84 CA1 (0.57) CA1CA2CA12CA7CA14
SCHEMBL5739726 0.84 CA1 (0.57) CA1CA2CA12CA7CA14
SCHEMBL5738672 0.83 CA1 (0.55) CA1CA2CA12CA7CA14
SCHEMBL5738668 0.83 CA1 (0.55) CA1CA2CA12CA7CA14
SCHEMBL5738892 0.83 CA1 (0.55) CA1CA2CA12CA7CA14
SCHEMBL5738304 0.80 GRM7 (0.44) CA1CA2CA12CA7CA14
SCHEMBL5738299 0.80 GRM7 (0.44) CA1CA2CA12CA7CA14
SCHEMBL5738104 0.80 GRM7 (0.40) CA1CA2CA12CA7CA14

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-20050282819-A1 Heterocyclic substituted indane derivatives and related compounds for the treatment of schizophrenia GRAHAM JAMES M 2005-12-22 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-20050282819-A1 Heterocyclic substituted indane derivatives and related compounds for the treatment of schizophrenia CHRM1, CHRM2, CHRM5 CA1 3909/4885CA2 4660/4885CA12 4291/4885

“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.