SCHEMBL20133367

SCHEMBL20133367

OCCCc1ccc(O)cn1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.44
ESR2 Q92731 7/20 0.44
CA2 P00918 1/20 0.37
LTA4H P09960 1/20 0.33
EPHX2 P34913 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
DEGS1 O15121 1/20 0.32
CNR1 P21554 1/20 0.31
FFAR1 O14842 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL20436993 0.94 ESR1 (0.43) ESR1ESR2CA2DEGS1
SCHEMBL2429377 0.87 ESR1 (0.47) ESR1ESR2CA2ALDH1A1LMNA
SCHEMBL6810902 0.82 ESR1 (0.47) ESR1ESR2LTA4HALDH1A1LMNA
SCHEMBL9406017 0.80 PTGS2 (0.50) ESR1ESR2LTA4HALDH1A1LMNA
SCHEMBL29216735 0.80 HRH1 (0.50) ESR1ESR2ALDH1A1
SCHEMBL19309207 0.79 PTGS2 (0.53) ESR1ESR2ALDH1A1LMNAHSD17B10
SCHEMBL1924446 0.78
SCHEMBL8665678 0.78 CCR1 (0.41) ALDH1A1
SCHEMBL18076939 0.78 DAO (0.44) CYP11B1CYP11B2
SCHEMBL3515320 0.78 CYP11B1 (0.41) ALDH1A1CYP11B1CYP11B2

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-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 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-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 ESR1 2718/4885ESR2 1489/4885CA2 3308/4885

“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.