SCHEMBL20156908

SCHEMBL20156908

Cc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(Cc4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.54
▸ RAB9A P51151 7/20 0.54
▸ POLB P06746 1/20 0.54
▸ L3MBTL1 Q9Y468 5/20 0.49
▸ TDP1 Q9NUW8 5/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ LTA4H P09960 2/20 0.45
▸ DPP4 P27487 1/20 0.44
▸ NR1H2 P55055 2/20 0.44
▸ NR1H3 Q13133 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ NFKB1 P19838 1/20 0.44

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
SCHEMBL20156933 0.93 MEN1 (0.53) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL20156851 0.90 MEN1 (0.53) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL22373679 0.90 CTRC (0.47) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL20091333 0.86 KMT2A (0.52) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL19155657 0.85 L3MBTL1 (0.60) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL22373677 0.84 RAB9A (0.53) NPC1RAB9AL3MBTL1TDP1SMN1; SMN2
SCHEMBL24299418 0.82 L3MBTL1 (0.70) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL19762192 0.81 L3MBTL1 (0.57) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL19035438 0.81 FFAR1 (0.39) NPC1RAB9APOLBL3MBTL1TDP1
SCHEMBL25643969 0.81 MEN1 (0.52) NPC1RAB9AL3MBTL1TDP1SMN1; SMN2

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-11031560-B2 Compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2021-06-08 — — US disclosed
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same LG CHEM, LTD. 2020-12-22 — — US disclosed
US-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 — — US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 — — US disclosed
US-20180138422-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-17 — — 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 (5 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-11031560-B2 Compound and organic electronic element comprising same OR10J3, ESR1, ETV6 NPC1 1634/4885RAB9A 3275/4885POLB 2363/4885
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 NPC1 3214/4885RAB9A 3113/4885POLB 3877/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 NPC1 3214/4885RAB9A 3113/4885POLB 3877/4885
US-20180138422-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ESR1, ETV6 NPC1 1634/4885RAB9A 3275/4885POLB 2363/4885
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same CRY1, CRY2, PER2 NPC1 3951/4885RAB9A 3102/4885POLB 2807/4885

“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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