SCHEMBL20086161

SCHEMBL20086161

N#Cc1cc(C#N)cc(-c2cc3c4ccccc4n4c5ccccc5c(c2)c34)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.38
CYP19A1 P11511 1/20 0.36
GRM5 P41594 2/20 0.35
ENPP3 O14638 1/20 0.35
IMPDH2 P12268 1/20 0.34
METAP2 P50579 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
TSHR P16473 1/20 0.33
ADORA2A P29274 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
RORC P51449 1/20 0.32
PGR P06401 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
SCHEMBL20086156 0.90 PTGER4 (0.44) PTGER4ENPP3IMPDH2METAP2CA1
SCHEMBL22679437 0.89 MAP4K4 (0.42) GRM5TSHRADORA2AKDM4EMEN1
SCHEMBL21710574 0.89 PTGER4 (0.40) PTGER4CYP19A1ENPP3CA1CA2
SCHEMBL20086148 0.88 KDM4E (0.36) PTGER4CYP19A1ENPP3KDM4EALDH1A1
SCHEMBL23898598 0.88 L3MBTL1 (0.37) CYP19A1CA1CA2MEN1ALDH1A1
SCHEMBL16621686 0.86 CYP19A1 (0.38) PTGER4CYP19A1METAP2TSHRADORA2A
SCHEMBL16621695 0.86 CYP19A1 (0.38) PTGER4CYP19A1METAP2TSHRADORA2A
SCHEMBL16621724 0.85 CYP19A1 (0.38) PTGER4CYP19A1METAP2TSHRADORA2A
SCHEMBL16621708 0.85 CYP19A1 (0.38) PTGER4CYP19A1METAP2TSHRADORA2A
SCHEMBL10153493 0.84 GPR3 (0.42) CYP19A1TSHRKDM4EMEN1ALDH1A1

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-10714694-B2 Delayed fluorescence material and organic light emitting device having the delayed fluorescence material Research & Business Foundation Sungkyunkwan University (KR) 2020-07-14 US disclosed
US-20180114924-A1 DELAYED FLUORESCENCE MATERIAL AND ORGANIC LIGHT EMITTING DEVICE HAVING THE DELAYED FLUORESCENCE MATERIAL Research & Business Foundation Sungkyunkwan University (KR) 2018-04-26 US disclosed
US-20180114924-A1 DELAYED FLUORESCENCE MATERIAL AND ORGANIC LIGHT EMITTING DEVICE HAVING THE DELAYED FLUORESCENCE MATERIAL Research & Business Foundation Sungkyunkwan University (KR) 2018-04-26 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-20180114924-A1 DELAYED FLUORESCENCE MATERIAL AND ORGANIC LIGHT EMITTING DEVICE HAVING THE DELAYED FLUORESCENCE MATERIAL GFPT1, ETFA, TFEB PTGER4 4130/4885CYP19A1 3633/4885GRM5 2834/4885
US-10714694-B2 Delayed fluorescence material and organic light emitting device having the delayed fluorescence material GFPT1, ETFA, TFEB PTGER4 4130/4885CYP19A1 3633/4885GRM5 2834/4885

“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.