Sugi Predict

Sugi Predict / Compounds / SCHEMBL19296554

SCHEMBL19296554

SCHEMBL19296554

c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc6ccccc6c5c5c6ccccc6ccc54)cc3)c3ccc(-c4cccc5ccccc45)cc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.38
▸ ACMSD Q8TDX5 1/20 0.38
▸ NTSR1 P30989 2/20 0.35
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ TLR4 O00206 1/20 0.34
▸ EDNRB P24530 1/20 0.33
▸ EDNRA P25101 1/20 0.33
▸ PDE6D O43924 1/20 0.33
▸ ALK Q9UM73 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SOS1 Q07889 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL19296534 0.94 NTSR1 (0.36) MCL1ACMSDNTSR1CA12CA1
SCHEMBL19296514 0.94 HDAC8 (0.35) MCL1ACMSDNTSR1CA12CA1
SCHEMBL19296549 0.93 SOS1 (0.34) MCL1ACMSDNTSR1TLR4PDE6D
SCHEMBL19296523 0.93 MCL1 (0.34) MCL1ACMSDNTSR1CA12CA1
SCHEMBL19296562 0.92 NTSR1 (0.35) MCL1ACMSDNTSR1CA12CA1
SCHEMBL14650088 0.91 PDE6D (0.35) MCL1ACMSDNTSR1CA12CA1
SCHEMBL14182852 0.91 MCL1 (0.36) MCL1ACMSDNTSR1CA12CA1
SCHEMBL23702372 0.90 ESR1 (0.37) MAPTCYP2C9CYP2C19KDM4EMEN1
SCHEMBL19296431 0.90 ESR1 (0.37) MAPTCYP2C9CYP2C19KDM4EMEN1
SCHEMBL19296505 0.90 ESR1 (0.37) MAPTCYP2C9CYP2C19KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10636976-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2020-04-28 — — US disclosed
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-31 — — US disclosed
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-31 — — 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 (2 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-10636976-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device TTI1, TTI2, TERF2 MCL1 2522/4885ACMSD 398/4885NTSR1 3983/4885
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE TTI1, TTI2, TERF2 MCL1 2522/4885ACMSD 398/4885NTSR1 3983/4885

“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.