SCHEMBL19921245

SCHEMBL19921245

Fc1ccc2cc3n(c2c1)CCC3

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.39
HTR2C P28335 7/20 0.39
SIGMAR1 Q99720 4/20 0.36
HTR7 P34969 1/20 0.35
KMT2A Q03164 2/20 0.33
ALOX5 P09917 1/20 0.33
AHR P35869 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 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
SCHEMBL18202191 0.86 SIGMAR1 (0.48) HTR2AHTR2CSIGMAR1KMT2AKDM4E
SCHEMBL24916793 0.81 SIGMAR1 (0.50) HTR2AHTR2CSIGMAR1KMT2AKDM4E
SCHEMBL26837141 0.80 HTR2A (0.65) HTR2AHTR2CSIGMAR1HTR7ALDH1A1
SCHEMBL30703022 0.76 HTR2A (0.64) HTR2AHTR2CSIGMAR1KDM4EALDH1A1
SCHEMBL761931 0.76 HTR2A (0.64) HTR2AHTR2CSIGMAR1KDM4EALDH1A1
SCHEMBL4048831 0.75 HTR2A (0.62) HTR2AHTR2CHTR7KMT2AALOX5
SCHEMBL18202248 0.75 HTR2A (0.38) HTR2AHTR2CSIGMAR1HTR7KMT2A
SCHEMBL30899241 0.75 HTR2C (0.68) HTR2AHTR2CHTR7AHR
SCHEMBL13279354 0.75 NOTUM (0.39) HTR2AHTR2CSIGMAR1AHR
SCHEMBL7173766 0.75 HTR2C (0.68) HTR2AHTR2CHTR7AHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3290419-B1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-08-07 EP disclosed
US-20180354953-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-12-13 US disclosed
US-10093656-B2 Fused-ring or tricyclic aryl pyrimidine compound used as kinase inhibitor NANJING SANHOME PHARMACEUTICAL CO., LTD (CN) 2018-10-09 US disclosed
EP-3312179-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-25 EP disclosed
US-20180072704-A1 Fused-Ring Or Tricyclic Aryl Pyrimidine Compound Used As Kinase Inhibitor GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-15 US disclosed
EP-3290419-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-07 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 (3 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-20180072704-A1 Fused-Ring Or Tricyclic Aryl Pyrimidine Compound Used As Kinase Inhibitor EGFR, ERBB2, ERBB4 HTR2A 3470/4885HTR2C 2254/4885SIGMAR1 4064/4885
US-10093656-B2 Fused-ring or tricyclic aryl pyrimidine compound used as kinase inhibitor EGFR, ERBB2, ERBB4 HTR2A 3470/4885HTR2C 2254/4885SIGMAR1 4064/4885
US-20180354953-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR EGFR, ERBB2, ERBB4 HTR2A 3470/4885HTR2C 2254/4885SIGMAR1 4064/4885

“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.