SCHEMBL18905573

SCHEMBL18905573

O=C(NCCc1ccco1)c1ccc(F)cc1F

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.56
NPC1 O15118 5/20 0.56
HPGD P15428 2/20 0.54
POLB P06746 2/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.49
GAA P10253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
HDAC3 O15379 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 1/20 0.45
BCL3 P20749 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL20124839 0.87 RAB9A (0.56) RAB9ANPC1HPGDPOLBMAPT
SCHEMBL18905579 0.78 NPC1 (0.49) RAB9ANPC1HPGDPOLBMAPT
SCHEMBL22776244 0.78 RAB9A (0.73) RAB9ANPC1POLBSMN1; SMN2KDM4E
SCHEMBL17807496 0.76 NPC1 (0.58) RAB9ANPC1HPGDPOLBMAPT
SCHEMBL5636971 0.75 ALPL (0.55) RAB9ANPC1MAPTL3MBTL1KDM4E
SCHEMBL12462063 0.75 HDAC3 (0.54) RAB9ANPC1L3MBTL1GAALMNA
SCHEMBL13753140 0.74 L3MBTL1 (0.54) RAB9ANPC1HPGDPOLBL3MBTL1
SCHEMBL12121121 0.74 POLB (0.69) RAB9ANPC1HPGDPOLBMAPT
SCHEMBL10352489 0.73 HPGD (0.53) RAB9ANPC1HPGDPOLBMAPT
SCHEMBL17950994 0.73 GCG (0.54) RAB9ANPC1L3MBTL1HDAC3BCL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10340466-B2 Organic metal compound, organic light-emitting devices employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-07-02 US disclosed
US-20170155065-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-06-01 US disclosed
US-20170155063-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-06-01 US disclosed
US-20170155063-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-06-01 US disclosed
US-20170155065-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-06-01 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 (3 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-20170155063-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME C5, C9, C1S RAB9A 2188/4885NPC1 2598/4885HPGD 3664/4885
US-10340466-B2 Organic metal compound, organic light-emitting devices employing the same OR10J3, C1S, C5 RAB9A 874/4885NPC1 2333/4885HPGD 4271/4885
US-20170155065-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT-EMITTING DEVICES EMPLOYING THE SAME OR10J3, C1S, C5 RAB9A 874/4885NPC1 2333/4885HPGD 4271/4885

“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.