SCHEMBL16658498

SCHEMBL16658498

c1ccc(-c2cc(-c3cc(-c4ccccn4)cc(-c4ccccn4)c3)c(-c3ccccc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HPGD P15428 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
KDM4E B2RXH2 2/20 0.37
TGFBR1 P36897 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
CCR1 P32246 2/20 0.37
CCR5 P51681 2/20 0.37
CCR8 P51685 2/20 0.37
TP53 P04637 2/20 0.37
ALPL P05186 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
SCHEMBL16658479 0.96 GRM5 (0.43) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL16658502 0.93 GRM5 (0.41) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL2733743 0.92 GRM5 (0.41) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL17014604 0.86 CCR1 (0.42) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL17014605 0.86 CCR1 (0.42) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL18058474 0.84 KDR (0.39) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL2734770 0.83 SMN1; SMN2 (0.46) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL3892684 0.83 TGFBR1 (0.44) GRM5SMN1; SMN2LMNANPC1RAB9A
SCHEMBL16859291 0.83 ALDH1A1 (0.44) SMN1; SMN2RAB9AHPGDKDM4EALDH1A1
SCHEMBL2158220 0.83 ALDH1A1 (0.47) SMN1; SMN2RAB9AHPGDKDM4EALDH1A1

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-10026901-B2 Organic electronic material and organic electroluminescent device GUANGDONG AGLAIA OPTOELECTRONICS MATERIALS CO., LTD (CN) 2018-07-17 US disclosed
US-10026901-B2 Organic electronic material and organic electroluminescent device GUANGDONG AGLAIA OPTOELECTRONICS MATERIALS CO., LTD (CN) 2018-07-17 US disclosed
US-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE BEIJING AGLAIA TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-04-23 US disclosed
US-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE BEIJING AGLAIA TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-04-23 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-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE OCIAD1, OCIAD2, SLCO4C1 GRM5 4369/4885SMN1; SMN2 2655/4885LMNA 3270/4885
US-10026901-B2 Organic electronic material and organic electroluminescent device OCIAD1, OCIAD2, SLCO4C1 GRM5 4369/4885SMN1; SMN2 2655/4885LMNA 3270/4885

“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.