SCHEMBL679561

SCHEMBL679561

O=C1C=C(c2ccccc2)CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 3/20 0.39
CFTR P13569 2/20 0.38
GOPC Q9HD26 2/20 0.38
HTT P42858 1/20 0.37
MYC P01106 1/20 0.37
WDR5 P61964 1/20 0.37
HPGD P15428 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
SCHEMBL731336 0.86 NPC1 (0.50) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL8178876 0.79 CHRNB4 (0.42) NPC1RAB9A
SCHEMBL5001783 0.79 CHRNB4 (0.42) ALDH1A1MAPTHTTHPGD
SCHEMBL678399 0.79 CYP11B2 (0.51) ALDH1A1
SCHEMBL678820 0.79 HSD17B1 (0.44)
SCHEMBL5793895 0.78 PTGS2 (0.42) NPC1RAB9APOLBALDH1A1MAPT
SCHEMBL11279823 0.78 MAPK14 (0.41) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL3519376 0.78 MAPK14 (0.41) ALDH1A1MAPT
SCHEMBL28756264 0.78 MT-CO2 (0.53) ALDH1A1MAPT
SCHEMBL5225774 0.78 HTR2C (0.37) NPC1RAB9AALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354829-A Preparation method and application of pentyenediamine adipate 中国科学院长春应用化学研究所 2023-06-30 CN claimed
CN-111217710-B Method for preparing 1, 5-pentanediamine by organic catalysis of L-lysine chemical decarboxylation 中国科学院长春应用化学研究所 2021-06-15 CN claimed
CN-111217710-A Method for preparing 1, 5-pentanediamine by organic catalysis of L-lysine chemical decarboxylation 中国科学院长春应用化学研究所 2020-06-02 CN claimed
US-4255292-A Perfuming composition containing 3-phenyl-cyclohex-2-en-1-one FIRMENICH SA (CH) 1981-03-10 US claimed
US-12509418-B2 Chromophoric compounds and UV-absorbing compositions LYGG CORPORATION (US) 2025-12-30 US disclosed
EP-4642424-A1 CHROMOPHORIC COMPOUNDS AND UV-ABSORBING COMPOSITIONS LYGG Corporation (US) 2025-11-05 EP disclosed
WO-2025206106-A1 METHODS FOR PRODUCING 3-PHENYLCYCLOHEXENONE COMPOUND AND DERIVATIVE THEREOF 住友化学株式会社 2025-10-02 WO disclosed
WO-2025206106-A1 METHODS FOR PRODUCING 3-PHENYLCYCLOHEXENONE COMPOUND AND DERIVATIVE THEREOF 住友化学株式会社 2025-10-02 WO disclosed
US-20250270164-A1 CHROMOPHORIC COMPOUNDS AND UV-ABSORBING COMPOSITIONS LYGG CORPORATION 2025-08-28 US disclosed
CN-116354829-B Preparation method and application of pentyenediamine adipate 中国科学院长春应用化学研究所 2025-02-07 CN disclosed
WO-2024145346-A1 CHROMOPHORIC COMPOUNDS AND UV-ABSORBING COMPOSITIONS LYGG CORPORATION (US) 2024-07-04 WO disclosed
US-20240018145-A1 POLYCYCLIC CAP-DEPENDENT ENDONUCLEASE INHIBITORS FOR TREATING OR PREVENTING INFLUENZA MERCK SHARP & DOHME LLC (US) 2024-01-18 US disclosed
US-5114493-A Smoking compositions containing a hexahydrobenzofuranone flavorant PHILIP MORRIS INC. (US) 1992-05-19 US disclosed
US-4255292-A Perfuming composition containing 3-phenyl-cyclohex-2-en-1-one FIRMENICH SA (CH) 1981-03-10 US disclosed
US-4255292-A Perfuming composition containing 3-phenyl-cyclohex-2-en-1-one FIRMENICH SA (CH) 1981-03-10 US disclosed
US-4255292-A Perfuming composition containing 3-phenyl-cyclohex-2-en-1-one FIRMENICH SA (CH) 1981-03-10 US disclosed
US-4127583-A Preparation of 3-(pyridinyl)-2-cyclohexene-1-ones STERLING DRUG INC. (US) 1978-11-28 US disclosed
US-4111946-A Preparation of 3-(pyridinyl)-2-cyclohexen-1-ones STERLING DRUG INC. (US) 1978-09-05 US disclosed
US-4075217-A Conversion of 3-(pyridinyl)-2-cyclohexen-1-one to 3-(pyridinyl)anilines STERLING DRUG INC. (US) 1978-02-21 US disclosed
US-4026900-A 3-(Pyridinyl)-2-cyclohexen-1-ones STERLING DRUG INC. (US) 1977-05-31 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 (3 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-20250270164-A1 CHROMOPHORIC COMPOUNDS AND UV-ABSORBING COMPOSITIONS ERCC1, TYR, ERCC5 NPC1 1517/4885RAB9A 2211/4885POLB 1012/4885
US-12509418-B2 Chromophoric compounds and UV-absorbing compositions LBR, ERCC1, MC1R NPC1 968/4885RAB9A 2940/4885POLB 940/4885
US-20240018145-A1 POLYCYCLIC CAP-DEPENDENT ENDONUCLEASE INHIBITORS FOR TREATING OR PREVENTING INFLUENZA DNASE1, RNASEH1, RNASE1 NPC1 902/4885RAB9A 3285/4885POLB 86/4885

“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.