SCHEMBL1809752

SCHEMBL1809752

[O]c1ccc2ccccc2c1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.61
ALDH1A1 P00352 6/20 0.61
HPGD P15428 5/20 0.61
KDM4E B2RXH2 4/20 0.61
GLA P06280 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
CYP1A2 P05177 1/20 0.61
CYP2C19 P33261 1/20 0.61
WDR5 P61964 1/20 0.52
METAP2 P50579 2/20 0.50
LDHA P00338 1/20 0.50
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
METAP1 P53582 1/20 0.50
CDC25B P30305 1/20 0.48
USP2 O75604 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
TSHR P16473 2/20 0.44

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
SCHEMBL4268 0.83 ALDH1A1 (0.61) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL29376732 0.83 ALDH1A1 (0.61) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL29593799 0.83 ALDH1A1 (0.61) HSD17B10ALDH1A1HPGDKDM4EGLA
Hydrochloric Acid SCHEMBL526822 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
Water SCHEMBL8971546 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
Bromide SCHEMBL7537985 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL4959080 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
SCHEMBL11769772 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
Calcium SCHEMBL4962060 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA
Ammonia Solution, Strong SCHEMBL9297223 0.82 ALDH1A1 (0.59) HSD17B10ALDH1A1HPGDKDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 HSD17B10 2848/4885ALDH1A1 218/4885HPGD 1067/4885

“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.