SCHEMBL17876105

SCHEMBL17876105

c1ccc(-c2cc(-c3ccc4c(c3)-c3cc(-c5ccc6oc7ccccc7c6c5)ccc3OCO4)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.45
ADORA1 P30542 4/20 0.44
ADORA2A P29274 2/20 0.44
ADORA3 P0DMS8 1/20 0.44
KDM4E B2RXH2 4/20 0.42
NPC1 O15118 4/20 0.42
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 3/20 0.40
LTB4R Q15722 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TNKS O95271 1/20 0.40
HPGD P15428 1/20 0.40
TP53 P04637 2/20 0.40
DHODH Q02127 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL17876076 0.96 ADORA1 (0.44) PDE10AADORA1ADORA2AADORA3KDM4E
SCHEMBL17876051 0.96 ADORA1 (0.44) PDE10AADORA1ADORA2AADORA3KDM4E
SCHEMBL17876099 0.93 ADORA1 (0.44) PDE10AADORA1ADORA2AADORA3KDM4E
SCHEMBL17876103 0.89 MAPT (0.44) PDE10AKDM4ENPC1MAPTALDH1A1
SCHEMBL17876073 0.89 ADORA1 (0.44) ADORA1ADORA2AADORA3KDM4ENPC1
SCHEMBL17876038 0.89 ADORA1 (0.44) ADORA1ADORA2AADORA3KDM4ENPC1
SCHEMBL17876107 0.87 KDM4E (0.42) ADORA1ADORA2AADORA3KDM4ENPC1
SCHEMBL17876100 0.87 MAPT (0.49) PDE10AKDM4ENPC1MAPTALDH1A1
SCHEMBL17876094 0.86 ALOX5 (0.47) ADORA1ADORA2AADORA3KDM4ENPC1
SCHEMBL17876113 0.86 ADORA1 (0.56) ADORA1ADORA2AADORA3KDM4ENPC1

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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 PDE10A 2881/4885ADORA1 3862/4885ADORA2A 4680/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 PDE10A 2881/4885ADORA1 3862/4885ADORA2A 4680/4885

“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.