SCHEMBL18372103

SCHEMBL18372103

O=P(c1ccccc1)(c1ccccc1)c1c2ccccc2c(-c2ccccc2)c2c3ccccc3c3ccccc3c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 3/20 0.41
▸ LMNA P02545 4/20 0.32
▸ MAPT P10636 4/20 0.32
▸ HTT P42858 2/20 0.32
▸ CA2 P00918 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ KDM4E B2RXH2 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL20746673 0.95 NPSR1 (0.38) NPSR1LMNAKMT2A
SCHEMBL18372118 0.94 NPSR1 (0.36) NPSR1LMNAMAPTHTT
SCHEMBL18372130 0.92 NPSR1 (0.40) NPSR1LMNAMAPTHTTCA2
SCHEMBL18372111 0.90 TOP1 (0.36) NPSR1LMNAMAPTHTTKDM4E
SCHEMBL18372136 0.86 LMNA (0.40) NPSR1LMNAMAPTHTTCA2
SCHEMBL18372163 0.86 LMNA (0.40) NPSR1LMNAMAPTHTTCA2
SCHEMBL18372115 0.86 LMNA (0.40) NPSR1LMNAMAPTHTTCA2
SCHEMBL18372082 0.86 KIF11 (0.40) MAPTALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL18372140 0.84 ESR1 (0.34) ALDH1A1CYP1A2CYP2C9HPGDHSD17B10
SCHEMBL11962351 0.84 NPSR1 (0.46) NPSR1LMNAMAPTHTTCA2

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-20170012209-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-12 — — US disclosed
US-20170012209-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-12 — — 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-20170012209-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE PIEZO1, TERT, TPR NPSR1 4592/4885LMNA 2224/4885MAPT 1255/4885

“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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