SCHEMBL26294458

SCHEMBL26294458

Cc1cccc(-c2nc(C(C)C)no2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.57
NPC1 O15118 9/20 0.57
GRM5 P41594 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.52
TP53 P04637 5/20 0.52
HSD17B10 Q99714 4/20 0.52
TSHR P16473 3/20 0.52
KDM4E B2RXH2 2/20 0.52
CASP3 P42574 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
MAPT P10636 2/20 0.51
GAA P10253 1/20 0.50
KCNT1 Q5JUK3 1/20 0.48
HPGD P15428 4/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
POLB P06746 2/20 0.48
MAOA P21397 1/20 0.46

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
SCHEMBL1544609 0.88 RAB9A (0.55) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL3108844 0.88 RAB9A (0.55) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL24590515 0.88 RAB9A (0.55) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL24482100 0.84 NPC1 (0.55) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL3086054 0.83 MAP4K4 (0.49) RAB9ANPC1SMN1; SMN2TP53HSD17B10
SCHEMBL10094554 0.83 TP53 (0.56) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL4101459 0.82 RAB9A (0.49) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL6979487 0.81 NR1H4 (0.57) RAB9ANPC1SMN1; SMN2TP53HSD17B10
SCHEMBL10094567 0.80 MAOA (0.43) RAB9ANPC1GRM5SMN1; SMN2TP53
SCHEMBL10094557 0.80 NPC1 (0.65) RAB9ANPC1GRM5SMN1; SMN2TP53

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-20230295145-A1 PYRROLIDINE DERIVATIVES AND METHODS OF USE GENENTECH INC (US) 2023-09-21 US disclosed
US-20230135152-A1 PIKFYVE KINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 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 (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-20230135152-A1 PIKFYVE KINASE INHIBITORS PIKFYVE, PIP5K1B, PIP5K1C RAB9A 794/4885NPC1 1153/4885GRM5 2649/4885
US-20230295145-A1 PYRROLIDINE DERIVATIVES AND METHODS OF USE DPYD, TP53, GLS RAB9A 2777/4885NPC1 1817/4885GRM5 1060/4885

“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.