SCHEMBL4148049

SCHEMBL4148049

CC(C)(C)N(C(=O)O)C(C)(C)Cc1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.53
ESR1 P03372 6/20 0.50
ESR2 Q92731 5/20 0.46
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 2/20 0.41
CA2 P00918 2/20 0.41
CAMK2A Q9UQM7 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
MTOR P42345 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
CYP3A4 P08684 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ESRRG P62508 1/20 0.36
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL227064 0.85 BLM (0.37) BLMESR1ESR2MEN1KMT2A
SCHEMBL6488489 0.81 FDPS (0.41) BLMMEN1KMT2ATSHRCYP3A4
SCHEMBL564589 0.76 BLM (0.49) BLMESR1ESR2MEN1KMT2A
SCHEMBL1205421 0.74 MAOA (0.42) MEN1KMT2ATSHROPRK1CYP3A4
SCHEMBL687076 0.73 BLM (0.40) BLMESR1ESR2MEN1KMT2A
SCHEMBL687077 0.73 BLM (0.40) BLMESR1ESR2MEN1KMT2A
SCHEMBL18527956 0.73 MEN1 (0.51) BLMESR1ESR2MEN1KMT2A
SCHEMBL11596247 0.72 BLM (0.67) BLMESR1ESR2MEN1KMT2A
SCHEMBL5004593 0.72 BLM (0.67) BLMESR1ESR2MEN1KMT2A
SCHEMBL1068241 0.71 ESR1 (0.70) BLMESR1ESR2MEN1KMT2A

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-7612084-B2 Amine derivatives for the treatment of asthma and COPD PFIZER INC (US) 2009-11-03 US disclosed
US-20090253739-A1 Amine Derivatives PFIZER INC 2009-10-08 US disclosed
US-20070265303-A1 Amine derivatives PFIZER LIMITED 2007-11-15 US 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 (2 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-20070265303-A1 Amine derivatives HNMT, HRH4, CMA1 BLM 1254/4885ESR1 2383/4885ESR2 1581/4885
US-20090253739-A1 Amine Derivatives HNMT, HRH4, CMA1 BLM 1254/4885ESR1 2383/4885ESR2 1581/4885

“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.