SCHEMBL18566124

SCHEMBL18566124

Cn1c2ccc3ccccc3c2c2ccc3c4ccccc4sc3c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRNP P04156 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ MAPT P10636 4/20 0.38
▸ TP53 P04637 2/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ GPR3 P46089 1/20 0.35
▸ ATM Q13315 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ NQO2 P16083 2/20 0.34
▸ NQO1 P15559 1/20 0.34
▸ MAPK9 P45984 1/20 0.32

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
SCHEMBL15127004 0.82 TDP1 (0.39) PRNPRAB9AMAPTRXFP1KDM4E
SCHEMBL13789931 0.82 HSD17B10 (0.46) PRNPRAB9AMAPTKDM4EGPR3
SCHEMBL15126974 0.81 HSD17B10 (0.34) PRNPRAB9AMAPTTP53RXFP1
SCHEMBL2604387 0.80 TSHR (0.44) PRNPRAB9AMAPTKDM4EGPR3
SCHEMBL13183677 0.79 ALKBH5 (0.50) RAB9AMAPTTP53RXFP1KDM4E
SCHEMBL18566146 0.79 MAPT (0.39) PRNPRAB9AMAPTTP53RXFP1
SCHEMBL18566148 0.79 PRNP (0.46) PRNPRAB9AMAPTTP53RXFP1
SCHEMBL18565436 0.79 ALOX5 (0.36) PRNPRAB9AMAPTRXFP1GPR3
SCHEMBL20110473 0.78 GPR3 (0.48) PRNPRAB9AMAPTTP53RXFP1
SCHEMBL17246642 0.78 KDM4E (0.37) RAB9AMAPTTP53RXFP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 — — 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-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 PRNP 2653/4885RAB9A 1488/4885MAPT 1057/4885

“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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