SCHEMBL27288985

SCHEMBL27288985

CCN1CCc2ccc(C(=O)Cl)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.45
HTR2A P28223 4/20 0.43
HTR2C P28335 4/20 0.43
HTR2B P41595 4/20 0.43
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
HDAC1 Q13547 5/20 0.41
HDAC6 Q9UBN7 5/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
NFKB1 P19838 1/20 0.40
HIF1A Q16665 1/20 0.40
NOTUM Q6P988 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
LMNA P02545 1/20 0.40
PMP22 Q01453 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GFER P55789 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL5404613 0.86 ACHE (0.46) ACHEHTR2AHTR2CHTR2BCHRM2
SCHEMBL13214309 0.82 XIAP (0.50) ACHEHDAC1HDAC6NPSR1KDM4E
SCHEMBL20195796 0.80 KMT2A (0.52) CYP1A2CYP2D6KDM4EMEN1ALDH1A1
SCHEMBL1916280 0.80 ACHE (0.39) ACHEHTR2AHTR2CHTR2BCHRM2
SCHEMBL20178669 0.79 ACHE (0.53) ACHECHRM2HDAC1HDAC6LMNA
SCHEMBL19675584 0.78 HPGD (0.51) KDM4EALDH1A1MAPTKMT2A
SCHEMBL18593246 0.78 ACHE (0.49) ACHECHRM2HDAC1HDAC6LMNA
SCHEMBL93954 0.76 ESR1 (0.54) HTR2AHTR2CHTR2BCHRM2CHRM3
SCHEMBL28942333 0.76 HTR2A (0.65) HTR2AHTR2CHTR2BCHRM2CHRM3
Ammonia Solution, Strong SCHEMBL906017 0.74 HTR2A (0.63) HTR2AHTR2CHTR2BCHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217967-A1 INDOLINE DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-07-04 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 (1 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-20240217967-A1 INDOLINE DERIVATIVES AS DDRS INHIBITORS DDR1, DDR2, DDRGK1 ACHE 4156/4885HTR2A 381/4885HTR2C 832/4885

“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.