SCHEMBL23319645

SCHEMBL23319645

Cc1cc(-c2cccc(Cl)c2)cnc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 3/20 0.52
LMNA P02545 2/20 0.52
RAB9A P51151 2/20 0.52
KMT2A Q03164 2/20 0.50
NPC1 O15118 1/20 0.50
MAP4K4 O95819 3/20 0.48
CYP2A6 P11509 1/20 0.45
VEGFA P15692 1/20 0.44
FLT1 P17948 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
EGLN3 Q9H6Z9 1/20 0.44
IDO1 P14902 1/20 0.42
CNR2 P34972 1/20 0.42
FYN P06241 1/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42

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
SCHEMBL26170180 0.86 ESR2 (0.54) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL22239384 0.83 ALOX5 (0.56) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL14478722 0.81 MAP4K4 (0.50) SMN1; SMN2MAPTRAB9ANPC1MAP4K4
SCHEMBL22239416 0.80 FYN (0.56) SMN1; SMN2MAPTLMNARAB9AKMT2A
SCHEMBL25763756 0.80 ESR2 (0.49) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL10017409 0.79 CYP1A2 (0.50) SMN1; SMN2MAPTRAB9AKMT2ANPC1
SCHEMBL2616121 0.79 SMN1; SMN2 (0.54) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL22239389 0.79 ESR2 (0.47) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL23514453 0.79 SMN1; SMN2 (0.47) ESR2SMN1; SMN2MAPTLMNARAB9A
SCHEMBL24011728 0.79 ESR2 (0.47) ESR2SMN1; SMN2MAPTLMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159462-A1 METHOD FOR PRODUCING NITROGEN-CONTAINING HETEROARYLCARBOXAMIDE ACETIC ACID DERIVATIVE KREOS CAPITAL VII (UK) LIMITED (GB) 2023-05-25 US disclosed
WO-2021087144-A1 THERAPEUTIC METHODS USING VADADUSTAT AKEBIA THERAPEUTICS, INC. (US) 2021-05-06 WO 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-20230159462-A1 METHOD FOR PRODUCING NITROGEN-CONTAINING HETEROARYLCARBOXAMIDE ACETIC ACID DERIVATIVE DIMT1, DLAT, COASY ESR2 4721/4885SMN1; SMN2 1359/4885MAPT 2241/4885

“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.