SCHEMBL20993469

SCHEMBL20993469

CCOC(=O)c1ccc(C2CC(C)CCN2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
ESR1 P03372 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
ESR2 Q92731 1/20 0.45
CA14 Q9ULX7 1/20 0.45
RAB9A P51151 3/20 0.45
CYP1A2 P05177 2/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAOA P21397 1/20 0.44
HTT P42858 4/20 0.43
MAPT P10636 2/20 0.43
ABL1 P00519 1/20 0.43
RIN1 Q13671 1/20 0.43
PKM P14618 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 2/20 0.41

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
SCHEMBL20993232 1.00 CA12 (0.45) CA12CA1CA2ESR1CA7
SCHEMBL20993454 1.00 CA12 (0.45) CA12CA1CA2ESR1CA7
SCHEMBL16409304 0.85 KDM4E (0.47) CA12CA1CA2CA7CA9
SCHEMBL17782270 0.85 KDM4E (0.47) CA12CA1CA2CA7CA9
SCHEMBL21806476 0.82 CA12 (0.49) CA12CA1CA2ESR1CA7
SCHEMBL28917392 0.80 CA1 (0.56) CA12CA1CA2ESR1CA7
SCHEMBL27507555 0.76 CA12 (0.54) CA12CA1CA2ESR1CA7
SCHEMBL28353488 0.76 CA12 (0.54) CA12CA1CA2ESR1CA7
SCHEMBL13862320 0.76 CA12 (0.47) CA12CA1CA2ESR1CA7
SCHEMBL16409393 0.74 KDM4E (0.42) CA12CA1CA2CA7CA9

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
US-20220119400-A1 QUINAZOLINE AND INDOLE COMPOUNDS TO TREAT MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2022-04-21 US disclosed
US-11248000-B2 Quinazoline and indole compounds to treat medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2022-02-15 US disclosed
EP-3448389-B1 QUINAZOLINE AND INDOLE COMPOUNDS TO TREAT MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2021-09-29 EP disclosed
US-10961252-B2 Quinazoline and indole compounds to treat medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-03-30 US disclosed
US-20200165262-A1 Quinazoline and Indole Compounds to Treat Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-05-28 US disclosed
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-09 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 (5 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-11248000-B2 Quinazoline and indole compounds to treat medical disorders CFB, TFPI, MAOB CA12 3045/4885CA1 4121/4885CA2 3192/4885
US-20220119400-A1 QUINAZOLINE AND INDOLE COMPOUNDS TO TREAT MEDICAL DISORDERS CFB, TFPI, MAOB CA12 3045/4885CA1 4121/4885CA2 3192/4885
US-10961252-B2 Quinazoline and indole compounds to treat medical disorders CFB, TFPI, MAOB CA12 3045/4885CA1 4121/4885CA2 3192/4885
US-20200165262-A1 Quinazoline and Indole Compounds to Treat Medical Disorders CFB, TFPI, MAOB CA12 3045/4885CA1 4121/4885CA2 3192/4885
US-20190135825-A1 Quinazoline and Indole Compounds to Treat Medical Disorders CFB, TFPI, MAOB CA12 3045/4885CA1 4121/4885CA2 3192/4885

“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.