SCHEMBL6908940

SCHEMBL6908940

COC(CNc1ccc2c(c1)C=C2)OC

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 2/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31

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
SCHEMBL6584102 0.74 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9122947 0.72 MAPT (0.39) ALDH1A1LMNAMAPTPSEN1PSEN2
SCHEMBL1728733 0.72 CA1 (0.47) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL241292 0.72 MAPT (0.41) ALDH1A1MEN1KMT2AMAPT
SCHEMBL11079274 0.71 MAPT (0.58) ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL7005993 0.71 ADRB3 (0.43) MEN1KMT2AMAPT
SCHEMBL6216871 0.71 MAPT (0.41) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL931749 0.71 MAPT (0.56) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL9124505 0.69 AR (0.39) ALDH1A1MEN1KMT2AMAPT
SCHEMBL19411103 0.69 MAPT (0.38) ALDH1A1LMNASMN1; SMN2MEN1KMT2A

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-6743818-B2 TREATING ANXIETY, PANIC ATTACKS, OBSESSIVE-COMPULSIVE DISORDERS, PHOBIAS, IMPULSIVE DISORDERS, DRUG ABUSE, COGNITIVE DISORDERS, PSYCHOSES, DEPRESSION AND MOOD DISORDERS LES LABORATOIRES SERVIER (FR) 2004-06-01 US disclosed
US-20030032812-A1 Cyclobutaindolecarboxamide compounds PEGLION JEAN-LOUIS (FR) 2003-02-13 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-20030032812-A1 Cyclobutaindolecarboxamide compounds CYP2W1, HRH4, CNR1 ALDH1A1 1028/4885LMNA 2071/4885SMN1; SMN2 519/4885

“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.