SCHEMBL5364485

SCHEMBL5364485

CC(C)(C)[Si](C)(C)Oc1ccc([C@H]2CC[C@H](NS(=O)(=O)c3ccc(F)cc3F)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.41
DPP7 Q9UHL4 5/20 0.41
KCNH2 Q12809 4/20 0.41
DPP8 Q6V1X1 3/20 0.41
DPP9 Q86TI2 3/20 0.41
HDAC8 Q9BY41 1/20 0.39
DRD2 P14416 6/20 0.38
ADRA1D P25100 6/20 0.38
ADRA1A P35348 6/20 0.38
ADRA1B P35368 6/20 0.38
HTR1A P08908 1/20 0.36
HTR2A P28223 1/20 0.36
HTR7 P34969 1/20 0.36
HTR6 P50406 1/20 0.36
TBXA2R P21731 2/20 0.35
SLC22A12 Q96S37 1/20 0.35
SLC2A9 Q9NRM0 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL5364491 1.00 DPP4 (0.41) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL5363841 0.88 HTR1A (0.43) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5363835 0.88 HTR1A (0.43) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5360086 0.85 L3MBTL1 (0.34) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5360089 0.85 L3MBTL1 (0.34) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5361288 0.83 KMT2A (0.44) DRD2ADRA1DADRA1AADRA1BHTR2A
SCHEMBL5361293 0.83 KMT2A (0.44) DRD2ADRA1DADRA1AADRA1BHTR2A
SCHEMBL6433894 0.82 PGR (0.37) DRD2HTR2AL3MBTL1
SCHEMBL6486732 0.82 PGR (0.37) DRD2HTR2AL3MBTL1
SCHEMBL6485691 0.82 PGR (0.37) DRD2HTR2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282592-B2 Resorcinol derivatives WARNER-LAMBERT COMPANY (US) 2007-10-16 US disclosed
US-20070122367-A1 RESORCINOL DERIVATIVES PFIZER INC. (US) 2007-05-31 US disclosed
US-7173052-B2 Resorcinol derivatives PFIZER INC. (US) 2007-02-06 US disclosed
US-20050282899-A1 Resorcinol for lightening skin removing color BRADLEY STUART E 2005-12-22 US disclosed
US-6852747-B2 Resorcinol derivatives PFIZER INC. (US) 2005-02-08 US disclosed
EP-1317425-B1 RESORCINOL DERIVATIVES PFIZER PROD INC (US) 2004-11-03 EP disclosed
US-20030180236-A1 Resorcinol derivatives PFIZER PRODUCTS, INC. 2003-09-25 US disclosed
US-6590105-B2 For skin lightening or depigmentation; works by inhibiting tyrosinase in humans; kits WARNER-LAMBERT COMPANY 2003-07-08 US disclosed
US-20020114770-A1 Resorcinol derivatives PFIZER INC. 2002-08-22 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 (4 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-20070122367-A1 RESORCINOL DERIVATIVES LRAT, NQO1, ALDH1A2 DPP4 1407/4885DPP7 2744/4885KCNH2 3280/4885
US-20030180236-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 DPP4 1407/4885DPP7 2744/4885KCNH2 3280/4885
US-20050282899-A1 Resorcinol for lightening skin removing color RBP4, NQO1, ALDH1A2 DPP4 639/4885DPP7 2203/4885KCNH2 2960/4885
US-20020114770-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 DPP4 1407/4885DPP7 2744/4885KCNH2 3280/4885

“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.