SCHEMBL2626997

SCHEMBL2626997

C1=C(c2ccc(N(c3ccc(C4=Cc5cc6ccccc6cc5C4)cc3)c3ccc(C4=Cc5cc6ccccc6cc5C4)cc3)cc2)Cc2cc3ccccc3cc21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.33
CYP11B2 P19099 3/20 0.33
CYP19A1 P11511 1/20 0.33
IP6K1 Q92551 1/20 0.32
IP6K3 Q96PC2 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL2627005 0.83 CYP11B1 (0.34) CYP11B1CYP11B2IP6K1IP6K3
SCHEMBL25736312 0.81 CYP11B1 (0.41) CYP11B1CYP11B2CYP19A1IP6K1IP6K3
SCHEMBL2626986 0.80 CYP11B2 (0.51) CYP11B1CYP11B2CYP19A1IP6K1IP6K3
SCHEMBL7090598 0.79 CYP11B2 (0.50) CYP11B1CYP11B2CYP19A1
SCHEMBL2627018 0.79 ALDH1A1 (0.32) CYP11B1CYP11B2CYP19A1
SCHEMBL2627027 0.78 CYP11B1 (0.38) CYP11B1CYP11B2CYP19A1IP6K1IP6K3
SCHEMBL2626975 0.77 CYP11B1 (0.43) CYP11B1CYP11B2CYP19A1IP6K1IP6K3
SCHEMBL2627026 0.76 CYP11B1 (0.46) CYP11B1CYP11B2CYP19A1IP6K1IP6K3
SCHEMBL25736341 0.75 IP6K1 (0.41) CYP11B1CYP11B2IP6K1IP6K3
SCHEMBL21776765 0.74 PTGS2 (0.41) CYP11B1CYP11B2CYP19A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8164251-B2 Aromatic amine derivatives and organic electroluminescence devices using the same IDEMITSU KOSAN CO., LTD. (JP) 2012-04-24 US disclosed
US-8164251-B2 Aromatic amine derivatives and organic electroluminescence devices using the same IDEMITSU KOSAN CO., LTD. (JP) 2012-04-24 US disclosed
US-20090085468-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-04-02 US disclosed
US-20090085468-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-04-02 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-20090085468-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME TYR, EML4, MAOA CYP11B1 2926/4885CYP11B2 2449/4885CYP19A1 1510/4885

“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.