SCHEMBL12758396

SCHEMBL12758396

Cc1nc2ccc(C(=O)Oc3ccccc3)cc2c(=O)o1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 3/20 0.56
▸ ALDH1A1 P00352 5/20 0.52
▸ MAPT P10636 5/20 0.52
▸ KMT2A Q03164 5/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ POLB P06746 3/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ NPBWR1 P48145 1/20 0.43
▸ CD74 P04233 1/20 0.42
▸ MIF P14174 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42

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
SCHEMBL692229 0.81 ELANE (0.66) ELANEALDH1A1KMT2AMEN1KDM4E
SCHEMBL258516 0.76 KMT2A (0.62) ELANEALDH1A1MAPTKMT2AMEN1
SCHEMBL4216662 0.75 KMT2A (0.59) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL692707 0.73 ELANE (0.68) ELANEMAPTKMT2AKDM4EPOLB
SCHEMBL12352090 0.73 ELANE (1.00) ELANEALDH1A1MAPTKMT2AMEN1
SCHEMBL6152188 0.72 MAPT (0.56) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL4753250 0.72 ALDH1A1 (0.56) ALDH1A1MAPTKMT2AMEN1
SCHEMBL10469445 0.72 MAPT (0.56) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL69953 0.72 MAPT (0.62) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL12352014 0.72 ELANE (0.66) ELANEALDH1A1NPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897761-B2 Heterocyclic compound FUJIFILM CORPORATION (JP) 2011-03-01 — — US disclosed
US-7897761-B2 Heterocyclic compound FUJIFILM CORPORATION (JP) 2011-03-01 — — US disclosed
US-20100004439-A1 Heterocyclic Compound FUJIFLM CORPORATION (JP) 2010-01-07 — — US disclosed
US-20100004439-A1 Heterocyclic Compound FUJIFLM CORPORATION (JP) 2010-01-07 — — US disclosed
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 — — US disclosed
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 — — 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 (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-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound CYP2A6, CYP2B6, XPO6 ELANE 1479/4885ALDH1A1 1360/4885MAPT 4345/4885
US-20100004439-A1 Heterocyclic Compound PTGER1, CYP1A1, ALOX12 ELANE 1343/4885ALDH1A1 1205/4885MAPT 4807/4885

“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.

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