SCHEMBL2382129

SCHEMBL2382129

NCCc1cccc(-c2ccoc2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.49
TAAR1 Q96RJ0 9/20 0.46
DRD2 P14416 1/20 0.46
DRD1 P21728 1/20 0.46
MAOB P27338 5/20 0.44
HTR6 P50406 2/20 0.41
HTR2C P28335 1/20 0.41
CYP2A6 P11509 1/20 0.41
HTR2A P28223 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
AKT2 P31751 1/20 0.40
CSNK2A1 P68400 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
SCHEMBL1013715 0.86 CSNK2A1 (0.53) TAAR1LOXL2CSNK2A1
Hydrochloric Acid SCHEMBL1015839 0.84 CSNK2A1 (0.55) TAAR1LOXL2CSNK2A1
SCHEMBL15244883 0.79 TAAR1 (0.63) HTR7TAAR1DRD2DRD1MAOB
SCHEMBL15349962 0.79 FYN (0.54)
SCHEMBL16160786 0.79 BCL2 (0.47) SMN1; SMN2
SCHEMBL420379 0.78 PPARD (0.54)
SCHEMBL172787 0.77 TAAR1 (0.62) HTR7TAAR1DRD2DRD1MAOB
Hydrochloric Acid SCHEMBL27718613 0.76 HTR7 (0.61) HTR7TAAR1DRD2DRD1MAOB
SCHEMBL15525063 0.74 MAOA (0.47) MAOBCSNK2A1
SCHEMBL422337 0.73 GRIN2D (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 US disclosed
US-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-29 US disclosed
EP-2177526-A1 10A-AZALIDE COMPOUND CROSSLINKED AT POSITION-10A AND POSITION-12 Taisho Pharmaceutical Co. Ltd. (JP) 2010-04-21 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-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS DCLRE1A, AZI2, CHD9 HTR7 1185/4885TAAR1 4720/4885DRD2 2603/4885

“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.