SCHEMBL5422882

SCHEMBL5422882

Cc1cccc(C)c1C1CCN(Cc2c(C)n(Cc3ccccc3)c3ccccc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLA2G2A P14555 1/20 0.46
GFER P55789 1/20 0.46
HTR2A P28223 1/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP19A1 P11511 1/20 0.42
ACHE P22303 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
C5AR1 P21730 1/20 0.42
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
POLB P06746 1/20 0.40
HTR6 P50406 1/20 0.40
TP53 P04637 1/20 0.40
CNR1 P21554 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
Hydrochloric Acid SCHEMBL5419432 0.99 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2TDP1PLA2G2A
SCHEMBL5415337 0.90 ALDH1A1 (0.49) KDM4EALDH1A1SMN1; SMN2TDP1PLA2G2A
Hydrochloric Acid SCHEMBL5415210 0.89 ALDH1A1 (0.51) KDM4EALDH1A1SMN1; SMN2TDP1PLA2G2A
SCHEMBL5430462 0.88 HTR2A (0.50) KDM4EALDH1A1SMN1; SMN2TDP1HTR2A
Hydrochloric Acid SCHEMBL5411540 0.87 HTR2A (0.49) KDM4EALDH1A1SMN1; SMN2TDP1HTR2A
SCHEMBL5423823 0.86 CNR1 (0.40) ALDH1A1MEN1KMT2AACHEDRD2
SCHEMBL5420593 0.78 CACNB4 (0.53) HTR2AKMT2ACYP19A1POLBHTR6
SCHEMBL5421524 0.78 ALDH1A1 (0.42) ALDH1A1HTR2ADRD2DRD4DRD3
SCHEMBL5417006 0.77 OPRL1 (0.39) KDM4ESMN1; SMN2MEN1KMT2ADRD2
Hydrochloric Acid SCHEMBL5419186 0.77 CACNB4 (0.52) HTR2AKMT2ACYP19A1POLBHTR6

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-20070197603-A1 Substituted indole ligands for the orl-1 receptor GLAXOSMITHKLINE S.P.A. (IT) 2007-08-23 US claimed
US-20070197603-A1 Substituted indole ligands for the orl-1 receptor GLAXOSMITHKLINE S.P.A. (IT) 2007-08-23 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-20070197603-A1 Substituted indole ligands for the orl-1 receptor OGFRL1, OPRL1, ORMDL3 KDM4E 4457/4885ALDH1A1 649/4885SMN1; SMN2 4321/4885

“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.