SCHEMBL20992183

SCHEMBL20992183

CC(C)=C(C)c1nc2c(I)cccc2n1C

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.30
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL17033307 0.82 TLR8 (0.39) CXCR3SMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL17050167 0.81 FBP1 (0.44) MAPT
SCHEMBL18649300 0.78 CASR (0.40) ALDH1A1MAPTRAB9ANPC1TP53
SCHEMBL17031843 0.78 CA2 (0.35) ALDH1A1MAPTTP53
SCHEMBL17040291 0.78 TLR8 (0.45) CXCR3SMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL17561705 0.74 CYP1A2 (0.49) SMN1; SMN2ALDH1A1MAPTRAB9ANPC1
SCHEMBL7981680 0.66 TLR8 (0.41) CXCR3SMN1; SMN2ALDH1A1MAPTTP53
SCHEMBL6953638 0.62 CXCR3 (0.56) CXCR3SMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL21439371 0.62 MCL1 (0.40) SMN1; SMN2ALDH1A1MAPTRAB9ANPC1
SCHEMBL1942206 0.61 PARP1 (0.45) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4129407-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS Achillion Pharmaceuticals, Inc. (US) 2023-02-08 EP disclosed
EP-3110418-B1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2019-11-06 EP disclosed
US-10287301-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-14 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-10287301-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders CFD, F12, F3 CXCR3 4323/4885SMN1; SMN2 2468/4885ALDH1A1 1682/4885

“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.