SCHEMBL16366151

SCHEMBL16366151

CC1(C)c2cc(Br)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.47
ALDH1A1 P00352 1/20 0.47
PDK2 Q15119 7/20 0.44
TDP2 O95551 2/20 0.40
PGR P06401 5/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
APAF1 O14727 1/20 0.37
THRB P10828 1/20 0.37
XBP1 P17861 1/20 0.37
PTBP1 P26599 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL431820 1.00 MAPK1 (0.47) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL29895759 1.00 MAPK1 (0.47) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL17153731 1.00 MAPK1 (0.47) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL429037 1.00 MAPK1 (0.47) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL14508377 0.93 PDK2 (0.39) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL30672516 0.92 ALDH1A1 (0.42) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL25502690 0.92 ALDH1A1 (0.42) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL824163 0.91 TDP2 (0.40) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL29721570 0.91 TDP2 (0.40) MAPK1ALDH1A1PDK2TDP2PGR
SCHEMBL14325947 0.91 MAPK1 (0.39) MAPK1ALDH1A1PDK2TDP2PGR

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-9871203-B2 Aromatic amine derivative, organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 US disclosed
US-9871203-B2 Aromatic amine derivative, organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 US disclosed
US-20150287921-A1 AROMATIC AMINE DERIVATIVE, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2015-10-08 US disclosed
US-20150287921-A1 AROMATIC AMINE DERIVATIVE, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2015-10-08 US disclosed
EP-2816025-A1 AROMATIC AMINE DERIVATIVE, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2014-12-24 EP 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-20150287921-A1 AROMATIC AMINE DERIVATIVE, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE RER1, AFF1, ESR2 MAPK1 2411/4885ALDH1A1 509/4885PDK2 3794/4885

“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.