SCHEMBL30336404

SCHEMBL30336404

CC1CCN(c2ccc(Nc3ccc4c(c3)ncn4C)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 3/20 0.46
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
GAA P10253 4/20 0.45
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 2/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 1/20 0.43
SYK P43405 2/20 0.42
GFER P55789 2/20 0.42
TP53 P04637 2/20 0.41
SHMT2 P34897 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL24865211 1.00 ALDH1A1 (0.46) ALDH1A1MAPTLMNADDB1CRBN
SCHEMBL24865084 0.90 ALDH1A1 (0.46) ALDH1A1MAPTLMNAGAANPC1
SCHEMBL30336260 0.90 ALDH1A1 (0.46) ALDH1A1MAPTLMNAGAANPC1
SCHEMBL24865606 0.86 ALDH1A1 (0.43) ALDH1A1MAPTLMNADDB1CRBN
SCHEMBL30336970 0.86 ALDH1A1 (0.43) ALDH1A1MAPTLMNADDB1CRBN
SCHEMBL24864844 0.82 MAPT (0.46) ALDH1A1MAPTLMNADDB1CRBN
SCHEMBL30336715 0.82 MAPT (0.46) ALDH1A1MAPTLMNADDB1CRBN
SCHEMBL31123358 0.81 FLT3 (0.44) ALDH1A1MAPTLMNAGAANPC1
SCHEMBL24865542 0.81 FLT3 (0.44) ALDH1A1MAPTLMNAGAANPC1
SCHEMBL24865699 0.81 ALDH1A1 (0.43) ALDH1A1MAPTLMNAGAANPC1

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
US-20240327393-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-10-03 US disclosed
CN-117999259-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-07 CN disclosed
WO-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 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-20240327393-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF AIFM2, GPX1, GPX4 ALDH1A1 1306/4885MAPT 3110/4885LMNA 1562/4885

“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.