SCHEMBL2201933

SCHEMBL2201933

Cc1ccc(N2CCCc3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.53
ALDH1A1 P00352 3/20 0.53
USP2 O75604 1/20 0.53
TSHR P16473 1/20 0.53
OPRM1 P35372 1/20 0.48
TP53 P04637 1/20 0.48
EED O75530 1/20 0.47
ROCK1 Q13464 1/20 0.47
NOTUM Q6P988 1/20 0.46
KMT2A Q03164 3/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MAPT P10636 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
PKM P14618 1/20 0.45
SIGMAR1 Q99720 1/20 0.45

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
SCHEMBL12307044 0.89 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1USP2TSHRTP53
SCHEMBL693233 0.85 ROCK1 (0.51) SMN1; SMN2ALDH1A1USP2TSHROPRM1
SCHEMBL29478502 0.85 ROCK1 (0.51) SMN1; SMN2ALDH1A1USP2TSHROPRM1
SCHEMBL11601096 0.83 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1TSHROPRM1TP53
SCHEMBL13426468 0.82 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1USP2TSHROPRM1
SCHEMBL24286724 0.82 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1EEDROCK1NOTUM
SCHEMBL13426582 0.80 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1USP2TSHROPRM1
SCHEMBL618870 0.80 OPRM1 (0.48) SMN1; SMN2ALDH1A1USP2TSHROPRM1
SCHEMBL17067809 0.80 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TSHRTP53NOTUM
SCHEMBL13426436 0.80 EED (0.48) SMN1; SMN2ALDH1A1TSHROPRM1TP53

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103288660-B N-methylation method of aromatic amine UNIV SHAANXI NORMAL 2014-09-17 CN disclosed
US-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20090084441-A1 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-02 US disclosed
EP-1885015-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION DEVICE Nippon Kayaku Kabushiki Kaisha (JP) 2008-02-06 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-20090084441-A1 Dye-sensitized photoelectric conversion device CRY1, H1-5, H1-0 SMN1; SMN2 3852/4885ALDH1A1 235/4885USP2 2541/4885

“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.