SCHEMBL19600929

SCHEMBL19600929

CCCCOC(=O)c1ccc(F)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.58
LMNA P02545 4/20 0.58
ESR1 P03372 4/20 0.58
CYP1A2 P05177 3/20 0.58
TSHR P16473 3/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2D6 P10635 2/20 0.58
MAPK1 P28482 1/20 0.58
NR1H2 P55055 1/20 0.58
RNASEL Q05823 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
CYP3A4 P08684 2/20 0.56
CYP2C9 P11712 1/20 0.56
PDE4D Q08499 1/20 0.56
HPGD P15428 3/20 0.51
RECQL P46063 1/20 0.51
MAPT P10636 4/20 0.50
ALDH1A1 P00352 2/20 0.50
RAB9A P51151 2/20 0.50
MEN1 O00255 2/20 0.50

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
SCHEMBL30692283 0.94 LMNA (0.60) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL6087503 0.84 CA12 (0.53) L3MBTL1LMNAESR1CYP1A2CYP2C19
SCHEMBL5127673 0.83 L3MBTL1 (0.60) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL7744434 0.83 L3MBTL1 (0.64) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL1461974 0.83 L3MBTL1 (0.60) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL12394101 0.82 LMNA (0.65) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL14560618 0.82 L3MBTL1 (0.63) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL13969984 0.82 L3MBTL1 (0.58) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL37476 0.80 ESR1 (0.85) L3MBTL1LMNAESR1CYP1A2TSHR
SCHEMBL5124868 0.79 LMNA (0.57) L3MBTL1LMNAESR1CYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2017-11-16 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 (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-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, MDM2, ESRRA L3MBTL1 3009/4885LMNA 3171/4885ESR1 61/4885

“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.