SCHEMBL30180415

SCHEMBL30180415

Cc1cnc(-c2ccccc2C(=O)O)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.51
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 3/20 0.49
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
MYC P01106 2/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
KDM4C Q9H3R0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX15 P16050 1/20 0.42
BRS3 P32247 4/20 0.41
LDHB P07195 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX12 P18054 1/20 0.40
HPGD P15428 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
SCHEMBL2656924 0.85 BCAT2 (0.51) ALDH1A1KDM4ETSHRRAB9ANPC1
SCHEMBL29743599 0.81 NPC1 (0.55) LDHAALDH1A1KDM4EUSP2TSHR
SCHEMBL21050082 0.81 NPC1 (0.55) LDHAALDH1A1KDM4EUSP2TSHR
SCHEMBL8841489 0.80 RAB9A (0.54) LDHAALDH1A1KDM4EUSP2TSHR
SCHEMBL8842317 0.79 RAB9A (0.52) LDHAALDH1A1KDM4EUSP2TSHR
SCHEMBL11957233 0.75 OPRK1 (0.40) LDHAALDH1A1TSHRRAB9ANPC1
SCHEMBL30227102 0.75 KDM4C (0.48) LDHAALDH1A1KDM4ETSHRMYC
SCHEMBL28532968 0.75 KDM4C (0.48) LDHAALDH1A1KDM4ETSHRMYC
SCHEMBL30776205 0.75 KDM4C (0.48) LDHAALDH1A1KDM4ETSHRMYC
SCHEMBL30776208 0.75 KDM4C (0.48) LDHAALDH1A1KDM4ETSHRMYC

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-12023319-B2 Carboxylic acid aromatic amides BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2024-07-02 US disclosed
US-20230043209-A1 CARBOXYLIC ACID AROMATIC AMIDES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2023-02-09 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-12023319-B2 Carboxylic acid aromatic amides DDC, PAH, NAT1 LDHA 421/4885ALDH1A1 135/4885KDM4E 1120/4885
US-20230043209-A1 CARBOXYLIC ACID AROMATIC AMIDES DDC, PAH, NAT1 LDHA 421/4885ALDH1A1 135/4885KDM4E 1120/4885

“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.