SCHEMBL21031996

SCHEMBL21031996

Cc1ccnc2c1ccc1ccc(-c3ccccc3)nc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.61
CCR8 P51685 3/20 0.61
CCR5 P51681 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
PSMD14 O00487 2/20 0.42
COPS5 Q92905 2/20 0.42
ADORA2A P29274 2/20 0.41
AURKA O14965 1/20 0.41
HSP90AA1 P07900 1/20 0.41
PRKACA P17612 1/20 0.41
PARP1 P09874 1/20 0.40
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 1/20 0.37
PDGFRB P09619 1/20 0.37
KDR P35968 1/20 0.37
FLT3 P36888 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 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
SCHEMBL21032004 0.97 CCR1 (0.58) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL25847351 0.90 CCR1 (0.54) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL30439568 0.83 TOP1 (0.44) CCR1CCR8CCR5L3MBTL1ADORA2A
SCHEMBL6328028 0.83 TOP1 (0.44) CCR1CCR8CCR5L3MBTL1ADORA2A
SCHEMBL29340587 0.82 CCR1 (0.53) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL29340588 0.82 CCR1 (0.53) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL29340589 0.82 CCR1 (0.53) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL21032002 0.82 CCR1 (0.64) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL23517029 0.81 HSP90AA1 (0.41) CCR1CCR8CCR5L3MBTL1ADORA2A
SCHEMBL16678847 0.81 ALDH1A1 (0.49) L3MBTL1ADORA2APARP1RAB9AALDH1A1

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-11691983-B2 Specifically substituted benzofuro- and benzothienoquinolines for organic light emitting diodes IDEMITSU KOSAN CO., LTD. (JP) 2023-07-04 US disclosed
US-11691983-B2 Specifically substituted benzofuro- and benzothienoquinolines for organic light emitting diodes IDEMITSU KOSAN CO., LTD. (JP) 2023-07-04 US disclosed
US-20190161497-A1 SPECIFICALLY SUBSTITUTED BENZOFURO- AND BENZOTHIENOQUINOLINES FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO., LTD. (JP) 2019-05-30 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-11691983-B2 Specifically substituted benzofuro- and benzothienoquinolines for organic light emitting diodes KCNQ2, KCNQ1, KCNQ4 CCR1 4431/4885CCR8 4738/4885CCR5 2749/4885
US-20190161497-A1 SPECIFICALLY SUBSTITUTED BENZOFURO- AND BENZOTHIENOQUINOLINES FOR ORGANIC LIGHT EMITTING DIODES KCNQ2, KCNQ1, KCNQ4 CCR1 4431/4885CCR8 4738/4885CCR5 2749/4885

“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.