SCHEMBL7124307

SCHEMBL7124307

Cn1c2c(c3ccccc31)-c1ccccc1C2CCC1c2ccccc2-c2c1n(C)c1ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.41
NTRK1 P04629 2/20 0.38
HTR2A P28223 2/20 0.36
HTR2C P28335 1/20 0.36
KDM4E B2RXH2 4/20 0.35
HSD17B10 Q99714 3/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
CDC25A P30304 1/20 0.35
CDC25C P30307 1/20 0.35
HSP90AA1 P07900 1/20 0.33
IDO1 P14902 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
FTO Q9C0B1 1/20 0.33
CCNB2 O95067 1/20 0.33

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
SCHEMBL7126885 0.91 GPR3 (0.41) GPR3NTRK1HTR2AHTR2CKDM4E
SCHEMBL7125908 0.80 KDM4E (0.46) HTR2AKDM4EALDH1A1GLAHPGD
SCHEMBL7125867 0.79 GPR3 (0.32) GPR3NTRK1
SCHEMBL7638144 0.78 GPR3 (0.41) GPR3NTRK1HTR2AHTR2CKDM4E
Hydrochloric Acid SCHEMBL7126873 0.77 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CKDM4E
Hydrochloric Acid SCHEMBL7125639 0.77 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CKDM4E
SCHEMBL7195665 0.77 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CKDM4E
SCHEMBL7128408 0.77 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CKDM4E
Hydrochloric Acid SCHEMBL7117726 0.77 GPR3 (0.40) GPR3NTRK1HTR2AHTR2CKDM4E
SCHEMBL7633864 0.76 GPR3 (0.39) GPR3NTRK1HTR2AHTR2CKDM4E

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-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation BASELL TECHNOLOGY COMPANY BV (NL) 2003-08-07 US disclosed
EP-0952978-B1 METALLOCENES AND CATALYSTS FOR OLEFIN-POLYMERISATION BASELL POLYOLEFINE GMBH (DE) 2003-01-22 EP disclosed
US-6451724-B1 BIS(N-METHYL-5,10-DIHYDROINDENO(1,2-B)INDOL-10 -YL)TITANIUM DICHLORIDE BASELL TECHNOLOGY COMPANY BV (NL) 2002-09-17 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 (1 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-20030148877-A1 Metallocenes and catalysts for olefin-polymerisation MT-CO1, CPNE4, MT-CO3 GPR3 3696/4885NTRK1 3468/4885HTR2A 3191/4885

“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.