SCHEMBL1960796

SCHEMBL1960796

C=CC(C(=O)O)c1[c]cccc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
AKT1 P31749 1/20 0.34
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
CYP2D6 P10635 1/20 0.32
TGM2 P21980 1/20 0.32
ALPI P09923 1/20 0.32
PKM P14618 1/20 0.32
PTGS1 P23219 1/20 0.32
XIAP P98170 1/20 0.32
SLC7A5 Q01650 1/20 0.32
LMNA P02545 3/20 0.31
MAPK1 P28482 1/20 0.31
KIF11 P52732 3/20 0.31
GRIK1 P39086 1/20 0.30

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
SCHEMBL9467544 0.75 SRC (0.54) SRCCYP1A2ALOX15TSHRCYP2D6
SCHEMBL2049372 0.73 ALDH1A1 (0.31) TSHR
SCHEMBL622284 0.72 CYP1A2 (0.57) SRCCYP1A2CYP2C19AKT1ALOX15
SCHEMBL21119246 0.72 CYP1A2 (0.57) SRCCYP1A2CYP2C19AKT1ALOX15
SCHEMBL12833352 0.72 CYP1A2 (0.57) SRCCYP1A2CYP2C19AKT1ALOX15
SCHEMBL4016238 0.72 PTGS2 (0.46) SRCCYP1A2CYP2C19TSHRCYP2D6
SCHEMBL27699174 0.72 ALPI (0.42) SRCCYP2C19CYP2D6ALPIPKM
SCHEMBL27630783 0.71 AKT1 (0.34) AKT1TGM2LMNAMAPK1
Hydrochloric Acid SCHEMBL10627471 0.71 CYP1A2 (0.55) SRCCYP1A2CYP2C19AKT1CYP2D6
SCHEMBL27976059 0.71 CYP1A2 (0.55) SRCCYP1A2CYP2C19AKT1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4520095-A STABLE CYAN DYE FOR COLOR DIFFUSION TRANSFER IN SILVER HALIDE EMULSION-CONTAINING FILMS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1985-05-28 US claimed
US-8877942-B2 2,2′-disubstituted dipyrrin compounds, synthesis thereof and methods of use thereof THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-11-04 US disclosed
US-20110144351-A1 2,2'-DISUBSTITUTED DIPYRRIN COMPOUNDS, SYNTHESIS THEREOF AND METHODS OF USE THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2011-06-16 US disclosed
US-4520095-A STABLE CYAN DYE FOR COLOR DIFFUSION TRANSFER IN SILVER HALIDE EMULSION-CONTAINING FILMS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1985-05-28 US disclosed
US-4520095-A STABLE CYAN DYE FOR COLOR DIFFUSION TRANSFER IN SILVER HALIDE EMULSION-CONTAINING FILMS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1985-05-28 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-20110144351-A1 2,2'-DISUBSTITUTED DIPYRRIN COMPOUNDS, SYNTHESIS THEREOF AND METHODS OF USE THEREOF DPP7, DPP4, DPP3 SRC 813/4885CYP1A2 819/4885CYP2C19 1357/4885

“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.