SCHEMBL1187919

SCHEMBL1187919

c1ccc2nc3cccc(-c4cccc5cccc(-c6cccc7nc8ccccc8cc67)c45)c3cc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.56
▸ KMT2A Q03164 7/20 0.56
▸ HPGD P15428 5/20 0.56
▸ KDM4E B2RXH2 4/20 0.56
▸ RAB9A P51151 4/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ GLA P06280 2/20 0.56
▸ GAA P10253 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ PTBP1 P26599 1/20 0.56
▸ RCE1 Q9Y256 1/20 0.56
▸ HSD17B10 Q99714 6/20 0.52
▸ TSHR P16473 4/20 0.52
▸ MAPK1 P28482 4/20 0.52
▸ MAPT P10636 4/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ ATM Q13315 1/20 0.52
▸ ACHE P22303 1/20 0.52
▸ CASP1 P29466 3/20 0.52

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
SCHEMBL4014126 0.92 KMT2A (0.64) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL1187275 0.86 ALDH1A1 (0.58) ALDH1A1KMT2AHPGDKDM4ERAB9A
Fluoranthene SCHEMBL7695122 0.86 ALDH1A1 (0.65) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL28917948 0.83 ALDH1A1 (0.55) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL1122659 0.82 ALDH1A1 (0.58) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL28854322 0.81 ALDH1A1 (0.54) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL28229302 0.81 ALDH1A1 (0.53) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL27956660 0.81 MBNL1 (0.54) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL28265823 0.81 ALDH1A1 (0.53) ALDH1A1KMT2AHPGDKDM4ERAB9A
SCHEMBL3109534 0.81 ALDH1A1 (0.73) ALDH1A1KMT2AHPGDKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7888509-B2 Chiral 1,8-diarylnaphthalenes, methods of making them, and their use as sensors GEORGETOWN UNIVERSITY (US) 2011-02-15 — — US disclosed
US-20070276140-A1 Chiral 1,8-Diarylnaphthalenes, Methods of Making Them, and Their Use as Sensors GEORGETOWN UNIVERSITY (US) 2007-11-29 — — US disclosed
WO-2005043124-A2 CHIRAL 1,8-DIARYLNAPHTHALENES, METHODS OF MAKING THEM, AND THEIR USE AS SENSORS GEORGETOWN UNIVERSITY (US) 2005-05-12 — — WO 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-20070276140-A1 Chiral 1,8-Diarylnaphthalenes, Methods of Making Them, and Their Use as Sensors ALKBH2, ALKBH1, ALG3 ALDH1A1 39/4885KMT2A 1186/4885HPGD 1080/4885

“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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