SCHEMBL5366944

SCHEMBL5366944

O=S(=O)(NC1CCC(c2ccc(O)cc2O)CC1)c1ccc(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.49
DPP7 Q9UHL4 5/20 0.49
KCNH2 Q12809 4/20 0.49
DPP8 Q6V1X1 3/20 0.49
DPP9 Q86TI2 3/20 0.49
HDAC8 Q9BY41 1/20 0.47
TBXA2R P21731 5/20 0.40
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SLC22A12 Q96S37 1/20 0.38
SLC2A9 Q9NRM0 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ACLY P53396 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL5366940 1.00 DPP4 (0.49) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL6598747 0.91 HTR1A (0.44) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL5355687 0.86 HSD17B1 (0.41) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL5355689 0.86 HSD17B1 (0.41) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL5356341 0.84 KMT2A (0.48) KMT2ATDP1
SCHEMBL5356347 0.84 KMT2A (0.48) KMT2ATDP1
SCHEMBL6599031 0.84 KMT2A (0.48) KMT2ATDP1
SCHEMBL5359472 0.81 KMT2A (0.40) KMT2ATDP1
SCHEMBL5359477 0.81 KMT2A (0.40) KMT2ATDP1
SCHEMBL5363002 0.77 KMT2A (0.52) HDAC8KMT2ATDP1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852747-B2 Resorcinol derivatives PFIZER INC. (US) 2005-02-08 US claimed
EP-1317425-B1 RESORCINOL DERIVATIVES PFIZER PROD INC (US) 2004-11-03 EP claimed
US-20030180236-A1 Resorcinol derivatives PFIZER PRODUCTS, INC. 2003-09-25 US claimed
EP-1317425-A2 RESORCINOL DERIVATIVES Pfizer Products Inc. (US) 2003-06-11 EP claimed
US-20020114770-A1 Resorcinol derivatives PFIZER INC. 2002-08-22 US claimed
WO-2002020474-A2 RESORCINOL DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-03-14 WO claimed
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.