SCHEMBL5743314

SCHEMBL5743314

Cc1cc(N2CCC(O)(c3ccc(F)cc3)CC2)nc(N)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
CRHBP P24387 2/20 0.52
CRHR2 Q13324 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 3/20 0.49
GFER P55789 1/20 0.49
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GRIN2B Q13224 1/20 0.46
AR P10275 1/20 0.45
KCNH2 Q12809 1/20 0.45
HRH3 Q9Y5N1 5/20 0.45
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
KDM4E B2RXH2 1/20 0.42
HRH4 Q9H3N8 2/20 0.41
OPRM1 P35372 1/20 0.40

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
SCHEMBL5741135 0.87 MAPT (0.61) LMNACRHBPCRHR2SMN1; SMN2MAPT
SCHEMBL22616898 0.80 KMT2A (0.62) LMNACRHBPCRHR2SMN1; SMN2MAPT
SCHEMBL17877575 0.80 CRHBP (0.48) LMNACRHBPCRHR2SMN1; SMN2MAPT
SCHEMBL22626849 0.78 GRIN2B (0.48) LMNASMN1; SMN2MAPTMEN1ALDH1A1
SCHEMBL942454 0.77 LMNA (0.42) LMNACRHBPCRHR2SMN1; SMN2MAPT
SCHEMBL27455408 0.77 CRHBP (0.66) CRHBPCRHR2SMN1; SMN2MAPTGFER
SCHEMBL30954002 0.77 CRHBP (0.66) CRHBPCRHR2SMN1; SMN2MAPTGFER
SCHEMBL5741147 0.74 HRH4 (0.49) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL605893 0.74 HRH4 (0.60) HRH3HRH4
SCHEMBL5742837 0.74 HRH4 (0.50) LMNASMN1; SMN2MAPTGFERHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220313701-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. 2022-10-06 US claimed
CN-114341125-A TREX1 modulators 星座制药公司 2022-04-12 CN claimed
EP-3962907-A1 MODULATORS OF TREX1 Constellation Pharmaceuticals, Inc. (US) 2022-03-09 EP claimed
WO-2020223590-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. (US) 2020-11-05 WO claimed
EP-1654249-A1 ANTHELMINTIC AND INSECTICIDE PYRIMIDINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2006-05-10 EP claimed
WO-2005014573-A1 ANTHELMINTIC AND INSECTICIDE PYRIMIDINE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2005-02-17 WO claimed
US-20050032810-A1 Novel anthelmintic and insecticidal compositions PHARMACIA AND UPJOHN COMPANY 2005-02-10 US claimed
US-20220313701-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. 2022-10-06 US disclosed
CN-114341125-A TREX1 modulators 星座制药公司 2022-04-12 CN disclosed
EP-3962907-A1 MODULATORS OF TREX1 Constellation Pharmaceuticals, Inc. (US) 2022-03-09 EP disclosed
WO-2020223590-A1 MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. (US) 2020-11-05 WO disclosed
EP-1654249-A1 ANTHELMINTIC AND INSECTICIDE PYRIMIDINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2006-05-10 EP disclosed
WO-2005014573-A1 ANTHELMINTIC AND INSECTICIDE PYRIMIDINE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2005-02-17 WO disclosed
US-20050032810-A1 Novel anthelmintic and insecticidal compositions PHARMACIA AND UPJOHN COMPANY 2005-02-10 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-20220313701-A1 MODULATORS OF TREX1 TEAD1, TREH, TSNAX LMNA 1336/4885CRHBP 2919/4885CRHR2 3548/4885
US-20050032810-A1 Novel anthelmintic and insecticidal compositions ACHE, DHX29, DHX35 LMNA 3571/4885CRHBP 4330/4885CRHR2 4871/4885

“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.