SCHEMBL20999624

SCHEMBL20999624

CC1(NC(=O)COc2ccc(Cl)cc2F)C=C(NC(=O)COc2ccc(Cl)c(Cl)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 4/20 0.41
▸ ATF4 P18848 8/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ KCNJ6 P48051 1/20 0.40
▸ KCNJ5 P48544 1/20 0.40
▸ KCNJ3 P48549 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PPARG P37231 1/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38

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
SCHEMBL20999049 0.88 ATF4 (0.51) ATF4
SCHEMBL20999599 0.88 GRIN1 (0.40) FFAR1ATF4MEN1KMT2AKCNJ6
SCHEMBL20999053 0.85 ALDH1A1 (0.47) NPC1TP53MAPTRAB9A
SCHEMBL19569431 0.85 ATF4 (0.47) FFAR1ATF4KCNJ6KCNJ5KCNJ3
SCHEMBL22669127 0.83 ATF4 (0.48) FFAR1ATF4TP53MAPTPPARG
SCHEMBL20973933 0.82 ATF4 (0.60) ATF4
SCHEMBL22669234 0.82 ATF4 (0.42) ATF4MEN1KMT2ANPC1TSHR
SCHEMBL22669170 0.81 ATF4 (0.48) ATF4NPC1RAB9A
SCHEMBL20999330 0.81 ATF4 (0.49) ATF4
SCHEMBL20999196 0.81 ATF4 (0.59) ATF4MEN1KMT2ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 — — US disclosed
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2019-05-16 — — 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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 FFAR1 1632/4885ATF4 1/4885MEN1 4714/4885
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 FFAR1 1632/4885ATF4 1/4885MEN1 4714/4885

“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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