SCHEMBL16645286

SCHEMBL16645286

COC(=O)C(Cc1c[nH]c2cc(OC)c(C)cc12)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
LMNA P02545 1/20 0.60
GAA P10253 1/20 0.57
HTT P42858 1/20 0.57
TACR1 P25103 8/20 0.55
NMBR P28336 2/20 0.55
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.49
MCL1 Q07820 1/20 0.49
HCRTR1 O43613 1/20 0.49
CA2 P00918 1/20 0.49

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
SCHEMBL19068574 1.00 MAPT (0.60) MAPTLMNAGAAHTTTACR1
SCHEMBL17938396 0.94 MAPT (0.60) MAPTLMNAGAAHTTTACR1
SCHEMBL17938398 0.93 MAPT (0.62) MAPTLMNAGAAHTTTACR1
SCHEMBL16645287 0.93 MAPT (0.62) MAPTLMNAGAAHTTTACR1
SCHEMBL16634516 0.87 MAPT (0.62) MAPTLMNAGAAHTTTACR1
SCHEMBL16645245 0.85 MAPT (0.61) MAPTLMNAGAAHTTTACR1
SCHEMBL17938406 0.85 MAPT (0.61) MAPTLMNAGAAHTTTACR1
SCHEMBL1318661 0.85 NMBR (0.73) MAPTLMNAGAAHTTTACR1
SCHEMBL29401413 0.85 NMBR (0.73) MAPTLMNAGAAHTTTACR1
SCHEMBL17319524 0.85 NMBR (0.73) MAPTLMNAGAAHTTTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9695174-B2 Inhibitor of breast cancer resistance protein (BCRP) MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-07-04 US disclosed
US-9695174-B2 Inhibitor of breast cancer resistance protein (BCRP) MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-07-04 US disclosed
US-20160214984-A1 INHIBITOR OF BREAST CANCER RESISTANCE PROTEIN (BCRP) TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-07-28 US disclosed
US-20160214984-A1 INHIBITOR OF BREAST CANCER RESISTANCE PROTEIN (BCRP) TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-07-28 US disclosed
WO-2015054132-A1 INHIBITOR OF BREAST CANCER RESISTANCE PROTEIN (BCRP) MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-04-16 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-20160214984-A1 INHIBITOR OF BREAST CANCER RESISTANCE PROTEIN (BCRP) BRCA1, ABCC1, IMPA1 MAPT 3799/4885LMNA 4679/4885GAA 4816/4885

“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.