SCHEMBL16362052

SCHEMBL16362052

Cc1cc2oc(=O)n(C)c2cc1-c1ccc(NCc2c(F)cccc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 5/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ IL2 P60568 4/20 0.41
▸ STIM1 Q13586 4/20 0.40
▸ ORAI1 Q96D31 4/20 0.40
▸ IDH1 O75874 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ TNF P01375 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ BRD4 O60885 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16362055 0.87 STIM1 (0.39) PKMMEN1KMT2AIL2STIM1
SCHEMBL17766404 0.81 IL2 (0.62) PKMMEN1KMT2AIL2STIM1
SCHEMBL17766402 0.79 IL2 (0.59) PKMMEN1KMT2AIL2STIM1
SCHEMBL16362398 0.78 IL2 (0.63) PKMMEN1KMT2AIL2STIM1
SCHEMBL17766373 0.78 MAPT (0.55) MEN1KMT2AIL2STIM1ORAI1
SCHEMBL16362040 0.77 IL2 (0.59) IL2STIM1ORAI1TNFMAPT
SCHEMBL17766394 0.76 IL2 (0.45) PKMMEN1KMT2AIL2STIM1
SCHEMBL17766385 0.75 KDM4E (0.48) PKMMEN1KMT2AIL2TP53
SCHEMBL17766359 0.74 CCNT1 (0.35) PKMMEN1KMT2AIL2STIM1
SCHEMBL16362039 0.73 MAOB (0.42) PKMMEN1KMT2AKDM4EPOLB

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9725463-B2 Substituted heterocyclic compounds as CRAC modulators LUPIN LIMITED (IN) 2017-08-08 — — US claimed
US-20160145268-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-26 — — US claimed
US-9725463-B2 Substituted heterocyclic compounds as CRAC modulators LUPIN LIMITED (IN) 2017-08-08 — — US disclosed
US-9725463-B2 Substituted heterocyclic compounds as CRAC modulators LUPIN LIMITED (IN) 2017-08-08 — — US disclosed
US-9725463-B2 Substituted heterocyclic compounds as CRAC modulators LUPIN LIMITED (IN) 2017-08-08 — — US disclosed
US-20160145268-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-26 — — US disclosed
US-20160145268-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-26 — — US disclosed
US-20160145268-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-26 — — US disclosed
WO-2014203217-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS LUPIN LIMITED (IN) 2014-12-24 — — WO 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-20160145268-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS CRAC MODULATORS RYR2, NR2C2, CACNA1E PKM 4423/4885MEN1 3052/4885KMT2A 3138/4885

“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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