SCHEMBL18969044

SCHEMBL18969044

c1ccc(N(c2ccccc2)c2cccc(C3(c4ccccc4)c4cccc5ccc6cccc3c6c45)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A1 P04798 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
CYP1B1 Q16678 1/20 0.30
HSD17B10 Q99714 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL18969046 0.93 KDM4E (0.31) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969043 0.93 KDM4E (0.31) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969058 0.90 ALDH1A1 (0.37) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969019 0.87 CHRNA1 (0.32) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969038 0.87 CHRNA1 (0.32) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969045 0.86 MCL1 (0.36) CYP1A2CYP2C9CYP2C19
SCHEMBL18969048 0.86 KDM4E (0.34) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6
SCHEMBL18969047 0.86 SIGMAR1 (0.36) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL18969039 0.85 CHRNA1 (0.32)
SCHEMBL18969036 0.85 KDM4E (0.33) ALDH1A1CYP1A2CYP3A4KDM4ECYP2D6

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-10361374-B2 Amine compound and organic light emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-23 US disclosed
US-20170170402-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 US disclosed
US-20170170402-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 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-20170170402-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME AOC2, MAOA, AOC3 ALDH1A1 78/4885CYP1A2 62/4885CYP3A4 656/4885
US-10361374-B2 Amine compound and organic light emitting device including the same AOC2, MAOA, AOC3 ALDH1A1 78/4885CYP1A2 62/4885CYP3A4 656/4885

“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.