SCHEMBL13507630

SCHEMBL13507630

Cn1c2cc(-c3ccc(-c4cccc5ccccc45)cc3)ccc2c2c3ccccc3c3c4ccc(-c5ccc6ccccc6c5)cc4n(C)c3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ LIMK1 P53667 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ALK Q9UM73 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ ENPP1 P22413 1/20 0.39
▸ MET P08581 1/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ FLT3 P36888 2/20 0.36
▸ PPARG P37231 4/20 0.36
▸ PPARA Q07869 4/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PPARD Q03181 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL13507635 0.97 MET (0.41) CA12CA1CA2CA9LIMK1
SCHEMBL13508170 0.94 CA12 (0.43) CA12CA1CA2CA9LIMK1
SCHEMBL13507850 0.91 LIMK1 (0.46) CA1CA2CA9LIMK1MAOB
SCHEMBL13507467 0.90 KDM4E (0.40) CA12CA1CA2CA9LIMK1
SCHEMBL13507734 0.89 LIMK1 (0.44) LIMK1MAOBHSD11B1HTR1DKDM4E
SCHEMBL13507633 0.88 MAOB (0.50) LIMK1MAOBHSD11B1HTR1DKDM4E
SCHEMBL13506862 0.88 MET (0.38) CA12CA1CA2CA9MAOB
SCHEMBL13507846 0.85 LIMK1 (0.41) LIMK1MAOBHSD11B1HTR1DKDM4E
SCHEMBL13507607 0.83 CA12 (0.43) CA12CA1CA2CA9MAOB
SCHEMBL13508164 0.83 LIMK1 (0.39) LIMK1MAOBHSD11B1HTR1DKDM4E

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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — US disclosed
US-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — 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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 CA12 3624/4885CA1 4267/4885CA2 2258/4885

“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.

Send feedback