SCHEMBL30041391

SCHEMBL30041391

c1ccc2c(N3CCNCC3)ccnc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 11/20 1.00
ADRB2 P07550 5/20 1.00
ADRB1 P08588 1/20 0.57
HTR6 P50406 4/20 0.56
HTR1A P08908 2/20 0.56
HTR1D P28221 2/20 0.56
HTR1B P28222 2/20 0.56
HTR2A P28223 2/20 0.56
HTR3E A5X5Y0 1/20 0.56
HTR3B O95264 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
HTR7 P34969 1/20 0.56
MTOR P42345 1/20 0.56
HTR3A P46098 1/20 0.56
HTR5A P47898 1/20 0.56
HTR3D Q70Z44 1/20 0.56
HTR3C Q8WXA8 1/20 0.56

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
SCHEMBL900231 1.00 NCF1 (1.00) NCF1ADRB2ADRB1HTR6HTR1A
Hydrochloric Acid SCHEMBL30061214 0.98 NCF1 (0.97) NCF1ADRB2ADRB1HTR6HTR1A
SCHEMBL23412205 0.94 NCF1 (0.88) NCF1ADRB2ADRB1HTR6HTR1A
SCHEMBL2884262 0.89 NCF1 (0.79) NCF1ADRB2ADRB1HTR6HTR1A
SCHEMBL30061245 0.87 NCF1 (0.77) NCF1ADRB2ADRB1HTR6HTR1A
Hydrochloric Acid SCHEMBL3711412 0.87 NCF1 (0.77) NCF1ADRB2ADRB1HTR6HTR1A
SCHEMBL14515644 0.84 NCF1 (0.73) NCF1ADRB2HSD17B10KDM4EALDH1A1
SCHEMBL3649189 0.84 NCF1 (0.73) NCF1ADRB2TSHRHSD17B10KDM4E
SCHEMBL19000048 0.83 NCF1 (0.71) NCF1ADRB2TSHRHSD17B10KDM4E
SCHEMBL28250832 0.83 NCF1 (0.71) NCF1ADRB2HSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119775261-A Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2025-04-08 CN disclosed
CN-115427404-B Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2024-12-13 CN disclosed
EP-4139291-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF Anima Biotech Inc. (US) 2023-03-01 EP disclosed
CN-115427404-A Collagen 1 translation inhibitors and methods of use thereof 艾尼莫生物科技公司 2022-12-02 CN disclosed
WO-2022235091-A1 NOVEL HETEROCYCLIC COMPOUND AND USE THEREOF 엠비디 주식회사 2022-11-10 WO disclosed