SCHEMBL2005168

SCHEMBL2005168

C=CCC1(C(=O)O)CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.54
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 2/20 0.41
TBXAS1 P24557 2/20 0.33
MME P08473 3/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
BLM P54132 1/20 0.32
CACNA2D1 P54289 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
Hydrochloric Acid SCHEMBL10824186 0.98 CYP2C19 (0.52) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL11634222 0.98 CYP2C19 (0.50) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL16151058 0.93 CYP2C19 (0.45) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL11664080 0.89 CYP2C19 (0.38) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL517571 0.89
SCHEMBL11498095 0.84 CYP2C19 (0.40) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL10824184 0.81 CYP2C19 (0.38) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL11264036 0.81 CYP2C19 (0.38) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL29308999 0.81 CYP2C19 (0.38) CYP2C19MEN1KMT2AALDH1A1POLB
SCHEMBL8437124 0.80 CYP2C19 (0.56) CYP2C19ALDH1A1TBXAS1MMEUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0222157-B1 RESIN COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-12-30 EP claimed
US-4886862-A MOISTURE-CURABLE SILYL-GROUP CONTAINING COPOLYMER OF A FLUOROALKYL PERVINYL ETHER AND A VINYL CARBOXYLATE, CATALYST AND SOLVENT; PAINTS; COATINGS, WEATHERPROOFING; HARDNESS DAINIPPON INK AND CHEMICALS, INC. (JP) 1989-12-12 US claimed
EP-0222157-A2 Resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 1987-05-20 EP claimed
US-4544767-A HYDROGENATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1985-10-01 US claimed
JP-6128196-A None JP disclosed
JP-4100891-A None JP disclosed
JP-57192336-A None JP disclosed
JP-55034206-A None JP disclosed
EP-3829559-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-13 EP disclosed
US-12577251-B2 Modulators of the sigma-2 receptor and their method of use Temple University—Of the Commonwealth System of Higher Education (US) 2026-03-17 US disclosed
EP-3200589-B1 NOVEL 5-HYDROXYTRYPTAMINE RECEPTOR 7 ACTIVITY MODULATORS AND THEIR METHOD OF USE UNIV TEMPLE (US) 2026-03-11 EP disclosed
US-12503458-B2 5-hydroxytryptamine receptor 7 activity modulators and their method of use TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2025-12-23 US disclosed
US-4770810-A Organic compound having a smectic phase A, and a mixture comprising this compound THOMSON-CSF (FR) 1988-09-13 US disclosed
EP-0222157-A2 Resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 1987-05-20 EP disclosed
US-4545921-A Liquid crystals having a type A smectic phase THOMSON-CSF (FR) 1985-10-08 US disclosed
US-4544767-A HYDROGENATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1985-10-01 US disclosed
JP-S57192336-A TRANS-4-(TRANS-4'-ALKYLCYCLOHEXYL)CYCLOHEXANECARBOXYLIC ACID PHENYL ESTER CHISSO CORP 1982-11-26 JP disclosed
US-4283420-A ANTICONVULSANTS, ANTIANAPHYLACTIC AGENTS, ANTIPSYCHOTIC AGENTS LABAZ (FR) 1981-08-11 US disclosed
US-4279770-A Liquid crystal 2,3-dicyano-hydroquinone derivatives CHISSO CORPORATION (JP) 1981-07-21 US disclosed
JP-S5534206-A NEMATIC LIQUID CRYSTAL FOR DISPLAY UNIT HITACHI LTD 1980-03-10 JP 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-12503458-B2 5-hydroxytryptamine receptor 7 activity modulators and their method of use HTR7, HTR5A, HTR6 CYP2C19 847/4885MEN1 3312/4885KMT2A 3078/4885
US-12577251-B2 Modulators of the sigma-2 receptor and their method of use SIGMAR1, CHRNA6, NR3C2 CYP2C19 528/4885MEN1 4861/4885KMT2A 4103/4885

“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.