SCHEMBL4181950

SCHEMBL4181950

O=C(NCc1ccccn1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.70
NPC1 O15118 1/20 0.70
POLB P06746 1/20 0.70
RAB9A P51151 1/20 0.70
SORT1 Q99523 1/20 0.67
KMT2A Q03164 5/20 0.67
PKM P14618 1/20 0.67
MEN1 O00255 4/20 0.65
MAPK14 Q16539 1/20 0.65
CA2 P00918 1/20 0.64
HPGD P15428 2/20 0.61
HSD17B10 Q99714 1/20 0.61
ALDH1A1 P00352 3/20 0.60
KDM4E B2RXH2 2/20 0.60
HTT P42858 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
TLR7 Q9NYK1 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
ALOX15 P16050 1/20 0.55

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
SCHEMBL11829303 0.89 SORT1 (0.65) LMNANPC1POLBRAB9ASORT1
SCHEMBL26703897 0.87 LMNA (0.67) LMNANPC1POLBRAB9ASORT1
SCHEMBL11626193 0.87 SORT1 (0.65) LMNANPC1POLBRAB9ASORT1
SCHEMBL11627869 0.86 RAB9A (0.66) LMNANPC1RAB9AKMT2APKM
SCHEMBL12042429 0.86 ALDH1A1 (0.73) LMNANPC1POLBRAB9AKMT2A
SCHEMBL14082655 0.86 LMNA (0.62) LMNANPC1POLBRAB9ASORT1
Hydrochloric Acid SCHEMBL11626061 0.85 SORT1 (0.64) LMNANPC1POLBRAB9ASORT1
SCHEMBL18031536 0.85 LMNA (0.74) LMNANPC1POLBRAB9AKMT2A
SCHEMBL949170 0.85 LMNA (0.73) LMNANPC1POLBRAB9AKMT2A
SCHEMBL166484 0.85 LMNA (0.82) LMNANPC1POLBRAB9AKMT2A

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-4069224-A N-(PYRIDYLALKYL)BENZAMIDES, IMPROVE PRODUCTION OF PROSTAGLANDINS IN MAMMALS THE UPJOHN COMPANY (US) 1978-01-17 US claimed
EP-4712965-A2 BENZIMIDAZOLE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD Springworks Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024238738-A2 BENZIMIDAZOLE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed
US-20240383891-A1 BENZIMIDAZOLE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD CISTIM LEUVEN VZW (BE) 2024-11-21 US disclosed
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRUENENTHAL GMBH (DE) 2009-03-12 US disclosed
US-4069224-A N-(PYRIDYLALKYL)BENZAMIDES, IMPROVE PRODUCTION OF PROSTAGLANDINS IN MAMMALS THE UPJOHN COMPANY (US) 1978-01-17 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-20240383891-A1 BENZIMIDAZOLE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD YAP1, TEAD2, TEAD1 LMNA 1774/4885NPC1 2103/4885POLB 1777/4885
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRM1, GRIN1, GRM2 LMNA 4687/4885NPC1 1077/4885POLB 4209/4885

“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.