SCHEMBL2105414

SCHEMBL2105414

CN1C2CCC1N(C(=O)c1n[nH]c3ccccc13)C2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 3/20 0.46
▸ HTR3A P46098 1/20 0.46
▸ RAB9A P51151 4/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ KDM4E B2RXH2 6/20 0.45
▸ YTHDC1 Q96MU7 1/20 0.45
▸ STAT3 P40763 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ RBP4 P02753 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ EIF4A3 P38919 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.43

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
SCHEMBL2013744 0.89 KDM4E (0.46) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL1175853 0.84 CHRNA7 (0.49) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL2087519 0.84 ALDH1A1 (0.52) CHRNA7HTR3ARAB9ANPC1KDM4E
Formic Acid SCHEMBL5562495 0.83 CHRNA7 (0.46) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL1176110 0.80 EIF4A3 (0.47) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL5038866 0.80 YTHDC1 (0.49) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL1176568 0.80 YTHDC1 (0.49) CHRNA7HTR3ARAB9ANPC1KDM4E
SCHEMBL2086496 0.79 FLT3 (0.49) CHRNA7HTR3ARAB9ANPC1KDM4E
Hydrochloric Acid SCHEMBL1175794 0.79 EIF4A3 (0.46) CHRNA7HTR3ARAB9ANPC1KDM4E
Formic Acid SCHEMBL5563473 0.78 YTHDC1 (0.45) CHRNA7HTR3ARAB9ANPC1KDM4E

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-8158629-B2 Indoles, 1H-indazoles, 1,2-benzisoxazoles, and 1,2-benzisothiazoles, and preparation and uses thereof MEMORY PHARMACEUTICALS CORPORATION (US) 2012-04-17 — — US disclosed
US-20110312989-A1 INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF XIE WENGE (US) 2011-12-22 — — 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-20110312989-A1 INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF CHRNA7, CHRNA5, CHRNA1 CHRNA7 1/4885HTR3A 45/4885RAB9A 2954/4885

“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.

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