SCHEMBL9611921

SCHEMBL9611921

c1ccc2c(c1)c(-c1ccc(-c3cn4ccccc4n3)cc1)cc1c3ccccc3c3ccccc3c21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 12/20 0.58
▸ NPC1 O15118 11/20 0.58
▸ KDM4E B2RXH2 11/20 0.58
▸ POLB P06746 2/20 0.58
▸ GFER P55789 3/20 0.57
▸ PKM P14618 5/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ EPHX2 P34913 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ MIF P14174 1/20 0.55
▸ ALDH1A1 P00352 8/20 0.54
▸ SMN1; SMN2 Q16637 7/20 0.54
▸ MAPK1 P28482 3/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.52
▸ MAPT P10636 5/20 0.50
▸ HPGD P15428 4/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ TSHR P16473 1/20 0.50

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
SCHEMBL9611827 0.92 RAB9A (0.51) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL9976929 0.91 RAB9A (0.54) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL9976905 0.90 RAB9A (0.60) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14478632 0.89 RAB9A (0.48) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL9611922 0.89 CASP3 (0.53) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL21499408 0.88 ALDH1A3 (0.55) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14478656 0.86 RAB9A (0.45) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL12197908 0.85 RAB9A (0.62) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL9611916 0.85 RAB9A (0.55) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL9976927 0.84 RAB9A (0.53) RAB9ANPC1KDM4EPOLBGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9126943-B2 Nitrogenated heterocyclic ring derivative and organic electroluminescent element comprising same IDEMITSU KOSAN CO., LTD. (JP) 2015-09-08 — — US disclosed
US-9126943-B2 Nitrogenated heterocyclic ring derivative and organic electroluminescent element comprising same IDEMITSU KOSAN CO., LTD. (JP) 2015-09-08 — — US disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-31 — — US disclosed
US-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-31 — — 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-20120132899-A1 NITROGENATED HETEROCYCLIC RING DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME H1-2, L1CAM, H1-0 RAB9A 1663/4885NPC1 1609/4885KDM4E 2763/4885

“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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