SCHEMBL1706102

SCHEMBL1706102

COc1cc2c(cc1OC)C[N]C2

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
CYP3A4 P08684 2/20 0.59
MAOA P21397 6/20 0.44
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 6/20 0.44
GAA P10253 1/20 0.44
CHRNA7 P36544 2/20 0.42
MAOB P27338 2/20 0.42
SLC6A4 P31645 1/20 0.42
GLA P06280 2/20 0.39
ACHE P22303 1/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 1/20 0.38
NQO2 P16083 1/20 0.38
TP53 P04637 1/20 0.38
NTSR1 P30989 1/20 0.38

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
SCHEMBL443555 0.84 MAOA (0.50) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL8543417 0.75 MAOA (0.55) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL9550647 0.75 MAPT (0.48) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL4571013 0.75 CYP3A4 (1.00) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL22953335 0.75 CYP3A4 (1.00) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL29924708 0.75 MAPT (0.68) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL14481557 0.75 MAPT (0.68) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL2594537 0.75 MAPT (0.68) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL2138785 0.75 CYP3A4 (1.00) MAPTCYP3A4MAOAKDM4EALDH1A1
SCHEMBL29394312 0.75 CYP3A4 (1.00) MAPTCYP3A4MAOAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023240024-A1 SULFAMIDE DERIVATIVES AS CYCLIN-DEPENDENT KINASE 2 INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2023-12-14 WO claimed
WO-2023240024-A1 SULFAMIDE DERIVATIVES AS CYCLIN-DEPENDENT KINASE 2 INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
US-8747810-B2 Compositions and methods for imaging tissues, organs and tumors PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-06-10 US disclosed
US-20120269724-A1 COMPOSITIONS AND METHODS FOR IMAGING TISSUES, ORGANS AND TUMORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-10-25 US disclosed
EP-2440584-A1 COMPOSITIONS AND METHODS FOR IMAGING TISSUES, ORGANS AND TUMORS President and Fellows of Harvard College (US) 2012-04-18 EP disclosed
WO-2010144891-A1 COMPOSITIONS AND METHODS FOR IMAGING TISSUES, ORGANS AND TUMORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-16 WO 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-20120269724-A1 COMPOSITIONS AND METHODS FOR IMAGING TISSUES, ORGANS AND TUMORS SSTR3, TACR1, SSTR5 MAPT 3819/4885CYP3A4 4212/4885MAOA 3370/4885

“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.