SCHEMBL1697236

SCHEMBL1697236

Oc1ccc2c(c1)COO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.43
ESR2 Q92731 4/20 0.40
ESR1 P03372 3/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
DRD2 P14416 2/20 0.35
DRD4 P21917 1/20 0.35
HSD17B10 Q99714 1/20 0.34
CA2 P00918 1/20 0.34
CA5A P35218 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PRKCI P41743 1/20 0.33
DPP4 P27487 1/20 0.33
DRD1 P21728 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
GSK3B P49841 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL1697250 0.83 CYP3A4 (0.43) CYP3A4ESR2ESR1ALDH1A1MAPT
SCHEMBL10770264 0.79 ESR2 (0.45) CYP3A4ESR2ESR1ALDH1A1MAPT
SCHEMBL6833886 0.78 AHR (0.43) MAPTRAB9AMAOB
SCHEMBL30792604 0.75 CYP3A4 (0.55) CYP3A4ESR2ESR1ALDH1A1MAPT
SCHEMBL11694183 0.74 CA1 (0.40) ALDH1A1MAPTDRD2CA2DRD3
SCHEMBL1383407 0.74 GSK3B (0.31) GSK3B
SCHEMBL2809969 0.74 GSK3B (0.33) GSK3B
SCHEMBL7158984 0.74 LMNA (0.50) CYP3A4ALDH1A1MAPTRAB9AHSD17B10
SCHEMBL11201231 0.74 MMP12 (0.38) ALDH1A1MAPTRAB9AHSD17B10GSK3B
SCHEMBL5880944 0.74 AHR (0.43) CYP3A4MAPTCA2GSK3B

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594811-B1 OXIDATION HAIR DYE BASED ON A CREAMY CARRIER AND PROCESS FOR DYEING HAIR WELLA AG (DE) 1996-06-12 EP claimed
EP-0375977-B1 Oxidation hairdyeing composition based upon diaminopyrazole derivatives, and these diaminopyrazole derivatives WELLA AG (DE) 1994-02-02 EP claimed
EP-0460128-B1 AGENT AND PROCESS FOR THE OXIDATIVE DYEING OF HAIR Wella Aktiengesellschaft (DE) 1993-06-09 EP claimed
EP-0241716-B1 PROCESS AND COMPOSITION FOR OXIDATIVE HAIR DYEING Wella Aktiengesellschaft (DE) 1990-08-29 EP claimed
EP-0166100-B1 OXIDATION HAIR-DYEING COMPOSITION BASED ON A LOW-VISCOSITY CARRIER Wella Aktiengesellschaft (DE) 1989-01-11 EP claimed
EP-0008080-B1 HAIR DYEING COMPOSITION Wella Aktiengesellschaft (DE) 1981-07-01 EP claimed
WO-2025207688-A1 DIBENZOFURAN PHOTOBASE GENERATORS FOR POLYIMIDE FORMATION NITTO DENKO CORPORATION (US) 2025-10-02 WO disclosed
US-12042480-B2 Methods, agents, and compositions for the treatment of acute myeloid leukemia UNIVERSITY OF CINCINNATI (US) 2024-07-23 US disclosed
US-20230255906-A1 Targeting Serpin B9 in Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-08-17 US disclosed
CN-114437008-B Synthesis method of (R) -3-phenyl-3-hydroxymethyl-2, 3-dihydrobenzofuran compound 常州大学 2023-07-25 CN disclosed
US-20220211669-A1 Methods, Agents, and Compositions for the Treatment of Acute Myeloid Leukemia UNIVERSITY OF CINCINNATI (US) 2022-07-07 US disclosed
CN-114437008-A Synthesis method of (R) -3-phenyl-3-hydroxymethyl-2, 3-dihydrobenzofuran compound 常州大学 2022-05-06 CN disclosed
US-11311513-B2 Methods, agents, and compositions for the treatment of acute myeloid leukemia UNIVERSITY OF CINCINNATI (US) 2022-04-26 US disclosed
WO-2002058658-A1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G - CLAIROL, INC. (US) 2002-08-01 WO disclosed
US-5865856-A MIXTURE CONTAINING COUPLER AND DEVELOPER WELLA AKTIENGESELLSCHAFT (DE) 1999-02-02 US disclosed
US-5480459-A Oxidative hair dye based on a creamlike carrier composition as well as process for the dyeing of hair WELLA AKTIENGESELLSCHAFT (DE) 1996-01-02 US disclosed
US-4797130-A DYE DEVELOPERS GOOD FOR RED COLORING WELLA AKTIENGESELLSCHAFT (DE) 1989-01-10 US disclosed
US-4713080-A OXIDATIVE COLORING WELLA AKTIENGESELLSCHAFT (DE) 1987-12-15 US disclosed
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-3962415-A Insecticide evaporator comprising DDVP with synergized benzodioxole compound as stabilizer AIRWICK INDUSTRIES, INC. (US) 1976-06-08 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-11311513-B2 Methods, agents, and compositions for the treatment of acute myeloid leukemia TET1, TET2, TET3 CYP3A4 2547/4885ESR2 2877/4885ESR1 3301/4885
US-20220211669-A1 Methods, Agents, and Compositions for the Treatment of Acute Myeloid Leukemia TET1, TET2, TET3 CYP3A4 2547/4885ESR2 2877/4885ESR1 3301/4885
US-12042480-B2 Methods, agents, and compositions for the treatment of acute myeloid leukemia TET1, TET2, TET3 CYP3A4 2547/4885ESR2 2877/4885ESR1 3301/4885
US-20230255906-A1 Targeting Serpin B9 in Cancer SERPINB10, SERPINB8, SERPINE1 CYP3A4 3222/4885ESR2 1341/4885ESR1 2320/4885

“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.