SCHEMBL21057752

SCHEMBL21057752

Fc1ccccc1Cn1ncc2cc(I)ccc21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RECQL P46063 1/20 0.41
PKM P14618 9/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PKLR P30613 7/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ADORA2A P29274 5/20 0.40
ADORA1 P30542 5/20 0.40
GRM2 Q14416 1/20 0.39

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
SCHEMBL3321752 0.83 ALDH1A1 (0.50) TSHRLMNATP53HPGDSMN1; SMN2
SCHEMBL24282845 0.83 PKM (0.47) TSHRLMNATP53HPGDSMN1; SMN2
SCHEMBL21058035 0.83 GRM2 (0.45) TSHRLMNATP53HPGDSMN1; SMN2
SCHEMBL2328936 0.82 RECQL (0.60) TSHRLMNATP53HPGDSMN1; SMN2
SCHEMBL21058132 0.77 RECQL (0.46) LMNARECQLPKMMAPTPKLR
SCHEMBL21058074 0.77 EGFR (0.50) RECQL
SCHEMBL3321530 0.76 PKM (0.42) RECQLPKMALDH1A1MAPTL3MBTL1
SCHEMBL21057768 0.75 HTR2A (0.52) RECQL
SCHEMBL14676530 0.74 TSHR (0.43) TSHRLMNATP53HPGDSMN1; SMN2
SCHEMBL443023 0.72 SMO (0.47)

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-12344605-B2 Substituted pyrrolidine amides II GRUENENTHAL GMBH (DE) 2025-07-01 US disclosed
US-20220127264-A1 SUBSTITUTED PYRROLIDINE AMIDES II GRUENENTHAL GMBH (DE) 2022-04-28 US disclosed
US-20220127264-A1 SUBSTITUTED PYRROLIDINE AMIDES II GRUENENTHAL GMBH (DE) 2022-04-28 US disclosed
EP-3728233-B1 SUBSTITUTED PYRROLIDINE AMIDES II GRUENENTHAL GMBH (DE) 2022-04-20 EP disclosed
EP-3728233-B1 SUBSTITUTED PYRROLIDINE AMIDES II GRUENENTHAL GMBH (DE) 2022-04-20 EP disclosed
EP-3728233-A1 SUBSTITUTED PYRROLIDINE AMIDES II Grünenthal GmbH (DE) 2020-10-28 EP disclosed
CN-111491931-A Substituted pyrrolidine amides II 格吕伦塔尔有限公司 2020-08-04 CN disclosed
US-20190185470-A1 Substituted Pyrrolidine Amides II GRUENENTHAL GMBH (DE) 2019-06-20 US disclosed
US-20190185470-A1 Substituted Pyrrolidine Amides II GRUENENTHAL GMBH (DE) 2019-06-20 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 (3 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-20190185470-A1 Substituted Pyrrolidine Amides II NR3C1, NR3C2, MC2R TSHR 124/4885LMNA 4704/4885TP53 3674/4885
US-20220127264-A1 SUBSTITUTED PYRROLIDINE AMIDES II NR3C1, NR3C2, MC2R TSHR 124/4885LMNA 4704/4885TP53 3674/4885
US-12344605-B2 Substituted pyrrolidine amides II NR3C1, NR3C2, MC2R TSHR 124/4885LMNA 4704/4885TP53 3674/4885

“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.