SCHEMBL20186802

SCHEMBL20186802

C#CCCC1NCCc2c1n([Si](C)(C)C(C)(C)C)c1ccccc21

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HTR2A P28223 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL20186744 0.86 HTR2A (0.39) ALDH1A1HTR2AHTR2CKDM4E
SCHEMBL18201257 0.74 ABCB1 (0.35) KDM4E
SCHEMBL20186640 0.70 NOD1 (0.36) ALDH1A1
SCHEMBL24506125 0.66 GRIN2B (0.62) HTR2AHTR2C
SCHEMBL20200994 0.64 SLC6A4 (0.42) HSD17B10MEN1ALDH1A1KMT2AHTR2A
SCHEMBL19786102 0.63 HTR2A (0.49) HSD17B10MEN1ALDH1A1HPGDKMT2A
SCHEMBL30005815 0.63 GPR3 (0.44) HSD17B10MEN1ALDH1A1HPGDKMT2A
SCHEMBL25738058 0.63 GPR3 (0.44) HSD17B10MEN1ALDH1A1HPGDKMT2A
SCHEMBL21883969 0.62 ABCB1 (0.45) HSD17B10MEN1ALDH1A1HPGDKMT2A
SCHEMBL23116646 0.61 PRCP (0.48) HSD17B10MEN1ALDH1A1HPGDKMT2A

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
EP-3288921-B1 POLYCYCLIC INDOLINE AND INDOLENINE COMPOUNDS UNIV COLORADO REGENTS (US) 2022-06-15 — — EP disclosed
US-10253024-B2 Polycyclic indoline and indolenine compounds THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2019-04-09 — — US disclosed
US-20180148442-A1 Polycyclic Indoline and Indolenine Compounds THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2018-05-31 — — 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-10253024-B2 Polycyclic indoline and indolenine compounds IDO1, IDO2, INMT HSD17B10 2495/4885MEN1 760/4885ALDH1A1 2671/4885
US-20180148442-A1 Polycyclic Indoline and Indolenine Compounds IDO1, IDO2, INMT HSD17B10 2495/4885MEN1 760/4885ALDH1A1 2671/4885

“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.

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