SCHEMBL5374256

SCHEMBL5374256

CC(C)(C)[Si](C)(C)Oc1ccc(C2CCC(NS(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.46
ADRA1D P25100 4/20 0.46
ADRA1A P35348 4/20 0.46
ADRA1B P35368 4/20 0.46
HTR1A P08908 1/20 0.42
HTR7 P34969 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
IDH2 P48735 4/20 0.40
NR3C1 P04150 1/20 0.39
PGR P06401 1/20 0.39
AR P10275 1/20 0.39
ESR2 Q92731 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
MMP1 P03956 1/20 0.39

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
SCHEMBL5374249 1.00 DRD2 (0.46) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5356423 0.88 HTR1A (0.42) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5356429 0.88 HTR1A (0.42) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5363019 0.88 HTR1A (0.42) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5356013 0.85 KMT2A (0.43) DRD2ADRA1DADRA1AADRA1BALDH1A1
SCHEMBL5356019 0.85 KMT2A (0.43) DRD2ADRA1DADRA1AADRA1BALDH1A1
SCHEMBL5363835 0.85 HTR1A (0.43) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5363841 0.85 HTR1A (0.43) DRD2ADRA1DADRA1AADRA1BHTR1A
SCHEMBL5360412 0.84 HRH2 (0.41) DRD2ADRA1DADRA1AADRA1BPGR
SCHEMBL5360407 0.84 HRH2 (0.41) DRD2ADRA1DADRA1AADRA1BPGR

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 8 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
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 DRD2 426/4885ADRA1D 607/4885ADRA1A 377/4885
US-20030180236-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 DRD2 426/4885ADRA1D 607/4885ADRA1A 377/4885
US-20050282899-A1 Resorcinol for lightening skin removing color RBP4, NQO1, ALDH1A2 DRD2 328/4885ADRA1D 1131/4885ADRA1A 599/4885
US-20020114770-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 DRD2 426/4885ADRA1D 607/4885ADRA1A 377/4885

“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.