SCHEMBL5419783

SCHEMBL5419783

C1CC2(CCN1)CNCNC2

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.34
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP3A4 P08684 1/20 0.30

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
SCHEMBL625429 0.87
SCHEMBL27184132 0.84 TSHR (0.40) TSHRCYP1A2CYP2D6USP2ALDH1A1
SCHEMBL5431066 0.84 TSHR (0.40) TSHRCYP1A2CYP2D6USP2ALDH1A1
SCHEMBL27170652 0.84 TSHR (0.35) TSHRCYP1A2CYP2D6USP2ALDH1A1
SCHEMBL473625 0.83
SCHEMBL27150426 0.81 TSHR (0.39) TSHRCYP2D6USP2ALDH1A1HPGD
SCHEMBL14239219 0.80 TSHR (0.31) TSHR
SCHEMBL303389 0.80 TSHR (0.41) TSHRCYP1A2CYP2D6USP2ALDH1A1
SCHEMBL29726153 0.78
SCHEMBL25683264 0.78

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-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US disclosed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 EP 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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 TSHR 254/4885CYP1A2 909/4885CYP2D6 208/4885

“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.