SCHEMBL993838

SCHEMBL993838

CCCCCCCCCCCCCCOc1ccc(C(=O)OC(C)OC(=O)N2CCCC2C(=O)OCc2ccccc2)o1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.46
▸ FKBP1A P62942 9/20 0.44
▸ KLK7 P49862 1/20 0.43
▸ KLK5 Q9Y337 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ PREP P48147 2/20 0.42
▸ TSHR P16473 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ACE P12821 1/20 0.40

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
SCHEMBL993837 1.00 PRCP (0.46) PRCPFKBP1AKLK7KLK5KDM4E
SCHEMBL16650233 0.85 FKBP1A (0.46) PRCPFKBP1AKLK7KLK5MEN1
SCHEMBL11985167 0.85 FKBP1A (0.51) FKBP1AKLK7KLK5KDM4ELMNA
SCHEMBL11980677 0.84 FKBP1A (0.50) FKBP1AKLK7KLK5KDM4ELMNA
SCHEMBL992358 0.78 KMT2A (0.46) LMNAMEN1KMT2ATDP1L3MBTL1
SCHEMBL10380778 0.77 PRCP (0.62) PRCPFKBP1AKLK7KLK5KDM4E
SCHEMBL12950571 0.77 PRCP (0.47) PRCPFKBP1AKLK7KLK5KDM4E
SCHEMBL11908914 0.76 MEN1 (0.46) KDM4EMEN1KMT2ATDP1TSHR
SCHEMBL992353 0.76 KMT2A (0.52) MEN1KMT2ATDP1TSHR
SCHEMBL15259720 0.75 TDP1 (0.43) PRCPMEN1KMT2ATDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434718-B2 TOFA analogs useful in treating dermatological disorders or conditions DERMIRA (CANADA), INC. (US) 2016-09-06 — — US claimed
EP-2641906-B1 Tofa analogs useful in treating dermatological disorders or conditions DERMIRA CANADA INC (US) 2015-04-22 — — EP claimed
US-20150025069-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA CANADA INC (US) 2015-01-22 — — US claimed
EP-2641906-A1 Tofa analogs useful in treating dermatological disorders or conditions Dermira (Canada), Inc. (US) 2013-09-25 — — EP claimed
EP-2451796-B1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA CANADA INC (US) 2013-04-17 — — EP claimed
EP-2451796-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Dermira (Canada), Inc. (CA) 2012-05-16 — — EP claimed
WO-2011005660-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Valocor Therapeutics, Inc. (CA) 2011-01-13 — — WO claimed
US-9782382-B2 TOFA analogs useful in treating dermatological disorders or conditions DERMIRA (CANADA), INC. (US) 2017-10-10 — — US disclosed
US-20160338988-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA (CANADA) INC (US) 2016-11-24 — — US disclosed
US-9434718-B2 TOFA analogs useful in treating dermatological disorders or conditions DERMIRA (CANADA), INC. (US) 2016-09-06 — — US disclosed
EP-2641906-B1 Tofa analogs useful in treating dermatological disorders or conditions DERMIRA CANADA INC (US) 2015-04-22 — — EP disclosed
US-20150025069-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA CANADA INC (US) 2015-01-22 — — US disclosed
EP-2641906-A1 Tofa analogs useful in treating dermatological disorders or conditions Dermira (Canada), Inc. (US) 2013-09-25 — — EP disclosed
EP-2451796-B1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS DERMIRA CANADA INC (US) 2013-04-17 — — EP disclosed
EP-2451796-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Dermira (Canada), Inc. (CA) 2012-05-16 — — EP disclosed
WO-2011005660-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Valocor Therapeutics, Inc. (CA) 2011-01-13 — — 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 (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-20150025069-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS FAH, CUTA, ALOX5AP PRCP 3052/4885FKBP1A 486/4885KLK7 3773/4885
US-20160338988-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS FAH, CUTA, ALOX5AP PRCP 3052/4885FKBP1A 486/4885KLK7 3773/4885

“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.

Send feedback