SCHEMBL26477338

SCHEMBL26477338

CCCCCc1ccc(-c2ncc(C(C)(C)C)c(C)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
MAPT P10636 4/20 0.55
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
USP2 O75604 1/20 0.55
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
HSD17B10 Q99714 1/20 0.55
RARB P10826 6/20 0.45
HSD11B1 P28845 2/20 0.42
NPC1 O15118 4/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
RARA P10276 1/20 0.40
MTOR P42345 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 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
SCHEMBL26480366 0.90 RAB9A (0.52) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL22275552 0.83 RAB9A (0.60) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11016694 0.82 RAB9A (0.58) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11016974 0.81 ALDH1A1 (0.61) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11018925 0.81 RAB9A (0.57) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11017647 0.81 ALDH1A1 (0.61) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11014658 0.81 RAB9A (0.57) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11018932 0.81 ALDH1A1 (0.61) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11016594 0.81 ALDH1A1 (0.61) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL11015017 0.81 ALDH1A1 (0.61) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E

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-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 US disclosed
US-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 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-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC RAB9A 2372/4885SMN1; SMN2 1689/4885MAPT 4006/4885

“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.