SCHEMBL14196985

SCHEMBL14196985

CCCC1(C)OC(=O)C(=C/C=C/C=C/Nc2ccccc2)C(=O)O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 12/20 0.46
▸ KMT2A Q03164 5/20 0.37
▸ CYP1A2 P05177 4/20 0.37
▸ CYP3A4 P08684 3/20 0.37
▸ CYP2C19 P33261 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ APP P05067 1/20 0.36
▸ CRHBP P24387 2/20 0.36
▸ CRHR2 Q13324 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 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
SCHEMBL14574025 0.90 ALDH1A1 (0.48) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL14574020 0.85 ALDH1A1 (0.62) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL14574032 0.84 ALDH1A1 (0.37) ALDH1A1KMT2AHPGDPOLBMEN1
SCHEMBL14574022 0.84 ALDH1A1 (0.38) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL14574027 0.84 RAB9A (0.41) ALDH1A1KMT2ACYP1A2CYP3A4POLB
SCHEMBL14574031 0.84 ALDH1A1 (0.38) ALDH1A1KMT2ACYP1A2CYP2C19HPGD
SCHEMBL14574021 0.81 ALDH1A1 (0.44) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL12260834 0.80 ALDH1A1 (0.66) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL14574026 0.80 ALDH1A1 (0.48) ALDH1A1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL14574029 0.75 ALDH1A1 (0.39) ALDH1A1KMT2ACYP1A2CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium FUJIFILM CORPORATION (JP) 2008-04-17 — — US disclosed
US-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium FUJIFILM CORPORATION (JP) 2008-04-17 — — US disclosed
US-7183422-B2 Oxonol compound and process for producing the compound FUJI PHOTO FILM CO., LTD. (JP) 2007-02-27 — — US disclosed
US-7183422-B2 Oxonol compound and process for producing the compound FUJI PHOTO FILM CO., LTD. (JP) 2007-02-27 — — 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 (1 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-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium KCNB1, KCNMB1, HCN2 ALDH1A1 445/4885KMT2A 2987/4885CYP1A2 1328/4885

“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.

Send feedback