SCHEMBL983328

SCHEMBL983328

COc1cc(OC)cc(C2c3ccc(OC)c(OC)c3CCN2C(C)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
PARP1 P09874 1/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HHAT Q5VTY9 1/20 0.42
MTNR1B P49286 3/20 0.41
TRPV1 Q8NER1 3/20 0.41
LHCGR P22888 2/20 0.39

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
SCHEMBL986756 0.91 PARP1 (0.45) TSHRPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL987136 0.88 PARP1 (0.42) TSHRPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL986563 0.88 TRPV1 (0.46) TSHRPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL986059 0.86 TRPV1 (0.42) TSHRPARP1MEN1KMT2ASMN1; SMN2
SCHEMBL985593 0.81 PARP1 (0.44) TSHRPARP1MEN1KMT2AMTNR1B
SCHEMBL985851 0.79 MTNR1B (0.56) TSHRMEN1KMT2ASMN1; SMN2MTNR1B
SCHEMBL983331 0.78 PARP1 (0.41) TSHRPARP1MEN1KMT2A
SCHEMBL985355 0.77 TSHR (0.58) TSHRMEN1KMT2ASMN1; SMN2MTNR1B
SCHEMBL987237 0.73 MTNR1B (0.51) TSHRMEN1KMT2ASMN1; SMN2MTNR1B
SCHEMBL4669565 0.73 TSHR (0.53) TSHRMEN1KMT2ASMN1; SMN2MTNR1B

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-7875631-B2 e.g.1-(3,5-dichlorophenyl)-2-formyl-6-methoxy-1,2,3,4-tetrahydroisoquinoline; to prevent and/or treat cancer and other abnormal cell growth, and metabolic as well as blood vessel proliferate disorders, in which uncontrolled expression of insulin-like growth factor-1 receptor is observed ANALYTECON S.A. (CH) 2011-01-25 US claimed
EP-1732898-B1 TETRAHYDROISOQUINOLINE- AND TETRAHYDROBENZAZEPINE DERIVATIVES AS IGF-1R INHIBITORS ANALYTECON SA (CH) 2008-01-23 EP claimed
US-20070129399-A1 Tetrahydroisoquinoline-and tetrahydrobenzazepine derivatives as igf-1r inhibitors ANALYTECON S.A. (CH) 2007-06-07 US claimed

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-20070129399-A1 Tetrahydroisoquinoline-and tetrahydrobenzazepine derivatives as igf-1r inhibitors IGF1R, INSR, GPR119 TSHR 42/4885PARP1 2752/4885MEN1 1041/4885

“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.