SCHEMBL11985068

SCHEMBL11985068

CC(OC(=O)c1ccc(O)o1)OC(=O)N1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ POLB P06746 3/20 0.39
▸ KMT2A Q03164 6/20 0.37
▸ RAB9A P51151 5/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ NPC1 O15118 5/20 0.36
▸ PRSS1 P07477 1/20 0.35
▸ TMPRSS15 P98073 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL19442077 0.88 CYP1A2 (0.41) ALDH1A1KMT2ARAB9ALMNATSHR
SCHEMBL11980687 0.87 ALDH1A1 (0.50) ALDH1A1POLBKMT2ARAB9AKDM4E
SCHEMBL19442050 0.85 SETD7 (0.43) ALDH1A1POLBKMT2ARAB9ALMNA
SCHEMBL11985253 0.83 MAPT (0.42) ALDH1A1POLBKMT2ATSHRMAPT
SCHEMBL19442010 0.81 ABHD6 (0.52) ALDH1A1POLBKMT2ARAB9ANPC1
SCHEMBL11985248 0.80 RAB9A (0.46) ALDH1A1POLBRAB9ALMNANPC1
SCHEMBL992353 0.77 KMT2A (0.52) ALDH1A1POLBKMT2ARAB9ATSHR
SCHEMBL11980688 0.75 POLB (0.44) ALDH1A1POLBKMT2ALMNATSHR
SCHEMBL11980684 0.73 ALDH1A1 (0.43) ALDH1A1POLBKMT2ARAB9ALMNA
SCHEMBL11985078 0.71 HTT (0.60) RAB9ANPC1MAPTSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782382-B2 TOFA analogs useful in treating dermatological disorders or conditions DERMIRA (CANADA), INC. (US) 2017-10-10 — — US disclosed
US-20120208807-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Valocor Therapeutics, Inc. (CA) 2012-08-16 — — 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-20120208807-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS FAH, CUTA, ALOX5AP ALDH1A1 1130/4885POLB 750/4885KMT2A 3026/4885

“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.

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