SCHEMBL20186663

SCHEMBL20186663

C#CCCC1c2c(c3ccccc3n2[Si](C)(C)C(C)(C)C)CCN1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 6/20 0.41
▸ ABCB1 P08183 4/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TBXA2R P21731 1/20 0.35
▸ PTGDR Q13258 1/20 0.35
▸ SMO Q99835 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ GRIN2C Q14957 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SLC6A7 Q99884 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 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
SCHEMBL18201257 0.84 ABCB1 (0.35) ABCG2ABCB1
SCHEMBL20186463 0.81 HTR6 (0.36) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL20186810 0.80 AKR1B10 (0.33) ALDH1A1ELANELMNA
SCHEMBL20186695 0.73 ABCB1 (0.38) ABCG2ABCB1ALDH1A1SMN1; SMN2MEN1
SCHEMBL20186640 0.72 NOD1 (0.36) ALDH1A1SMN1; SMN2LMNA
SCHEMBL20186802 0.71 HSD17B10 (0.31) ALDH1A1MEN1KMT2A
SCHEMBL20186647 0.69 HTR6 (0.37) ALDH1A1TBXA2RPTGDRSMN1; SMN2KMT2A
SCHEMBL20186692 0.68 HSD11B1 (0.34) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL20186744 0.67 HTR2A (0.39) ALDH1A1LMNA
SCHEMBL5273285 0.61 ALDH1A1 (0.57) ABCG2ABCB1ALDH1A1LMNA

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 ABCG2 1597/4885ABCB1 736/4885ALDH1A1 2671/4885
US-20180148442-A1 Polycyclic Indoline and Indolenine Compounds IDO1, IDO2, INMT ABCG2 1597/4885ABCB1 736/4885ALDH1A1 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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